Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
|
|
1852 | 1b1v RC | 4292 | cing | recoord | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H GLU 1 H GLU 1 -10.718 -11.887 19.572
2 HA GLU 1 HA GLU 1 -8.779 -10.680 18.875
3 1HB GLU 1 1HB GLU 1 -9.173 -13.499 18.645
4 2HB GLU 1 2HB GLU 1 -8.173 -13.032 17.284
5 1HG GLU 1 1HG GLU 1 -6.785 -13.585 19.270
6 2HG GLU 1 2HG GLU 1 -6.565 -11.914 18.788
7 H ASN 2 H ASN 2 -7.227 -10.312 16.970
8 HA ASN 2 HA ASN 2 -7.971 -10.621 14.375
9 1HB ASN 2 1HB ASN 2 -8.654 -8.183 13.843
10 2HB ASN 2 2HB ASN 2 -9.880 -9.170 14.611
11 1HD2 ASN 2 1HD2 ASN 2 -10.921 -8.260 16.198
12 2HD2 ASN 2 2HD2 ASN 2 -10.341 -7.036 17.278
13 H PHE 3 H PHE 3 -6.120 -10.041 13.155
14 HA PHE 3 HA PHE 3 -4.422 -7.916 14.143
15 1HB PHE 3 1HB PHE 3 -3.817 -10.216 15.216
16 2HB PHE 3 2HB PHE 3 -3.433 -10.775 13.601
17 HD1 PHE 3 HD1 PHE 3 -2.518 -8.193 16.110
18 HD2 PHE 3 HD2 PHE 3 -1.311 -10.395 12.688
19 HE1 PHE 3 HE1 PHE 3 -0.188 -7.293 16.351
20 HE2 PHE 3 HE2 PHE 3 1.018 -9.493 12.930
21 HZ PHE 3 HZ PHE 3 1.553 -7.954 14.760
22 H ASN 4 H ASN 4 -4.927 -6.803 12.192
23 HA ASN 4 HA ASN 4 -4.102 -8.202 9.781
24 1HB ASN 4 1HB ASN 4 -5.280 -6.103 8.699
25 2HB ASN 4 2HB ASN 4 -6.285 -7.356 9.400
26 1HD2 ASN 4 1HD2 ASN 4 -5.624 -4.105 9.296
27 2HD2 ASN 4 2HD2 ASN 4 -6.437 -3.562 10.726
28 H GLY 5 H GLY 5 -1.871 -7.563 11.077
29 1HA GLY 5 1HA GLY 5 0.023 -6.422 10.143
30 2HA GLY 5 2HA GLY 5 -0.975 -5.002 9.906
31 H GLY 6 H GLY 6 -2.386 -5.001 12.433
32 1HA GLY 6 1HA GLY 6 -1.631 -5.166 14.792
33 2HA GLY 6 2HA GLY 6 -0.140 -4.409 14.269
34 H CYS 7 H CYS 7 -3.647 -3.774 13.528
35 HA CYS 7 HA CYS 7 -3.164 -1.032 14.446
36 1HB CYS 7 1HB CYS 7 -4.656 -2.047 12.045
37 2HB CYS 7 2HB CYS 7 -5.102 -0.522 12.785
38 H LEU 8 H LEU 8 -5.645 -0.030 14.725
39 HA LEU 8 HA LEU 8 -6.750 -1.664 16.816
40 1HB LEU 8 1HB LEU 8 -6.490 0.658 17.240
41 2HB LEU 8 2HB LEU 8 -7.332 1.101 15.768
42 HG LEU 8 HG LEU 8 -9.443 0.480 16.647
43 1HD1 LEU 8 1HD1 LEU 8 -7.884 -0.943 18.803
44 2HD1 LEU 8 2HD1 LEU 8 -9.604 -0.525 18.993
45 3HD1 LEU 8 3HD1 LEU 8 -9.090 -1.601 17.671
46 1HD2 LEU 8 1HD2 LEU 8 -8.317 2.606 17.511
47 2HD2 LEU 8 2HD2 LEU 8 -9.726 1.998 18.412
48 3HD2 LEU 8 3HD2 LEU 8 -8.082 1.720 19.036
49 H ALA 9 H ALA 9 -7.964 -0.184 13.727
50 HA ALA 9 HA ALA 9 -9.146 -2.305 12.631
51 1HB ALA 9 1HB ALA 9 -10.717 -1.371 15.005
52 2HB ALA 9 2HB ALA 9 -11.624 -1.821 13.541
53 3HB ALA 9 3HB ALA 9 -10.546 -3.004 14.319
54 H GLY 10 H GLY 10 -8.784 -1.139 10.751
55 1HA GLY 10 1HA GLY 10 -10.177 0.097 9.170
56 2HA GLY 10 2HA GLY 10 -10.445 1.289 10.425
57 H TYR 11 H TYR 11 -7.668 1.198 11.494
58 HA TYR 11 HA TYR 11 -6.547 3.164 9.828
59 1HB TYR 11 1HB TYR 11 -5.441 1.312 12.032
60 2HB TYR 11 2HB TYR 11 -4.594 2.735 11.459
61 HD1 TYR 11 HD1 TYR 11 -5.845 5.017 11.681
62 HD2 TYR 11 HD2 TYR 11 -6.939 1.481 13.827
63 HE1 TYR 11 HE1 TYR 11 -7.072 6.431 13.402
64 HE2 TYR 11 HE2 TYR 11 -8.163 2.907 15.540
65 HH TYR 11 HH TYR 11 -9.268 5.182 15.525
66 H MET 12 H MET 12 -4.422 3.099 8.744
67 HA MET 12 HA MET 12 -3.932 0.431 7.665
68 1HB MET 12 1HB MET 12 -2.985 1.856 5.669
69 2HB MET 12 2HB MET 12 -4.726 1.769 5.845
70 1HG MET 12 1HG MET 12 -4.916 3.982 6.539
71 2HG MET 12 2HG MET 12 -3.359 3.982 7.343
72 1HE MET 12 1HE MET 12 -4.117 6.431 5.829
73 2HE MET 12 2HE MET 12 -2.440 6.229 6.391
74 3HE MET 12 3HE MET 12 -2.762 6.756 4.722
75 H ARG 13 H ARG 13 -1.616 0.083 6.881
76 HA ARG 13 HA ARG 13 0.126 1.266 8.862
77 1HB ARG 13 1HB ARG 13 0.394 -1.194 7.069
78 2HB ARG 13 2HB ARG 13 1.708 -0.618 8.076
79 1HG ARG 13 1HG ARG 13 -0.957 -0.983 9.418
80 2HG ARG 13 2HG ARG 13 -0.115 -2.442 8.934
81 1HD ARG 13 1HD ARG 13 1.776 -0.612 10.187
82 2HD ARG 13 2HD ARG 13 0.389 -0.822 11.238
83 HE ARG 13 HE ARG 13 0.930 -3.410 10.482
84 1HH1 ARG 13 1HH1 ARG 13 2.950 -0.837 11.779
85 2HH1 ARG 13 2HH1 ARG 13 4.044 -1.921 12.571
86 1HH2 ARG 13 1HH2 ARG 13 2.374 -4.841 11.527
87 2HH2 ARG 13 2HH2 ARG 13 3.714 -4.214 12.427
88 H THR 14 H THR 14 1.032 3.173 8.088
89 HA THR 14 HA THR 14 1.451 3.673 5.344
90 HB THR 14 HB THR 14 2.816 5.623 6.404
91 HG1 THR 14 HG1 THR 14 3.155 4.164 8.363
92 1HG2 THR 14 1HG2 THR 14 0.001 5.120 7.507
93 2HG2 THR 14 2HG2 THR 14 0.823 6.697 7.418
94 3HG2 THR 14 3HG2 THR 14 0.350 5.854 5.923
95 H ALA 15 H ALA 15 4.007 4.754 5.132
96 HA ALA 15 HA ALA 15 5.495 2.297 4.810
97 1HB ALA 15 1HB ALA 15 5.478 5.038 3.700
98 2HB ALA 15 2HB ALA 15 7.104 4.350 3.929
99 3HB ALA 15 3HB ALA 15 5.908 3.493 2.927
100 H ASP 16 H ASP 16 4.875 4.044 7.454
101 HA ASP 16 HA ASP 16 7.660 4.050 8.312
102 1HB ASP 16 1HB ASP 16 6.250 6.224 8.386
103 2HB ASP 16 2HB ASP 16 5.324 5.465 9.666
104 H GLY 17 H GLY 17 4.482 2.644 8.600
105 1HA GLY 17 1HA GLY 17 4.080 0.633 9.704
106 2HA GLY 17 2HA GLY 17 5.396 0.957 10.815
107 H ARG 18 H ARG 18 3.711 3.863 10.417
108 HA ARG 18 HA ARG 18 2.534 3.522 12.991
109 1HB ARG 18 1HB ARG 18 2.485 5.936 11.109
110 2HB ARG 18 2HB ARG 18 2.031 5.959 12.801
111 1HG ARG 18 1HG ARG 18 4.429 5.052 13.278
112 2HG ARG 18 2HG ARG 18 4.797 5.488 11.621
113 1HD ARG 18 1HD ARG 18 4.509 7.805 12.018
114 2HD ARG 18 2HD ARG 18 3.482 7.545 13.414
115 HE ARG 18 HE ARG 18 6.430 7.486 13.365
116 1HH1 ARG 18 1HH1 ARG 18 3.511 6.705 15.168
117 2HH1 ARG 18 2HH1 ARG 18 4.320 6.642 16.699
118 1HH2 ARG 18 1HH2 ARG 18 7.498 7.403 15.384
119 2HH2 ARG 18 2HH2 ARG 18 6.603 7.041 16.822
120 H CYS 19 H CYS 19 0.494 2.650 13.194
121 HA CYS 19 HA CYS 19 -1.207 2.241 11.058
122 1HB CYS 19 1HB CYS 19 -1.658 2.270 14.038
123 2HB CYS 19 2HB CYS 19 -2.955 1.925 12.910
124 H LYS 20 H LYS 20 -1.795 4.034 9.812
125 HA LYS 20 HA LYS 20 -2.770 6.385 11.247
126 1HB LYS 20 1HB LYS 20 -1.273 5.942 8.804
127 2HB LYS 20 2HB LYS 20 -2.715 6.882 8.475
128 1HG LYS 20 1HG LYS 20 -2.078 8.634 9.919
129 2HG LYS 20 2HG LYS 20 -1.047 7.603 10.891
130 1HD LYS 20 1HD LYS 20 0.680 7.557 9.214
131 2HD LYS 20 2HD LYS 20 -0.390 8.186 7.977
132 1HE LYS 20 1HE LYS 20 1.043 10.011 8.688
133 2HE LYS 20 2HE LYS 20 -0.566 10.346 9.294
134 1HZ LYS 20 1HZ LYS 20 0.213 9.206 11.380
135 2HZ LYS 20 2HZ LYS 20 1.731 9.326 10.791
136 3HZ LYS 20 3HZ LYS 20 0.856 10.676 11.074
137 HA PRO 21 HA PRO 21 -6.855 5.737 9.998
138 1HB PRO 21 1HB PRO 21 -7.764 8.156 9.108
139 2HB PRO 21 2HB PRO 21 -7.586 7.766 10.807
140 1HG PRO 21 1HG PRO 21 -5.880 9.485 9.112
141 2HG PRO 21 2HG PRO 21 -5.978 9.418 10.860
142 1HD PRO 21 1HD PRO 21 -3.915 8.297 9.213
143 2HD PRO 21 2HD PRO 21 -4.074 8.131 10.950
144 H THR 22 H THR 22 -8.216 4.927 8.439
145 HA THR 22 HA THR 22 -7.081 5.238 5.741
146 HB THR 22 HB THR 22 -8.893 3.008 6.777
147 HG1 THR 22 HG1 THR 22 -7.075 2.469 7.916
148 1HG2 THR 22 1HG2 THR 22 -6.821 3.227 4.531
149 2HG2 THR 22 2HG2 THR 22 -7.614 1.711 5.022
150 3HG2 THR 22 3HG2 THR 22 -8.578 3.034 4.323
151 H PHE 23 H PHE 23 -9.265 6.759 7.548
152 HA PHE 23 HA PHE 23 -11.730 6.577 6.601
153 1HB PHE 23 1HB PHE 23 -10.089 9.177 6.638
154 2HB PHE 23 2HB PHE 23 -11.810 9.048 6.935
155 HD1 PHE 23 HD1 PHE 23 -11.744 6.623 8.754
156 HD2 PHE 23 HD2 PHE 23 -9.384 10.150 8.662
157 HE1 PHE 23 HE1 PHE 23 -11.301 6.392 11.214
158 HE2 PHE 23 HE2 PHE 23 -8.942 9.918 11.122
159 HZ PHE 23 HZ PHE 23 -9.906 8.042 12.368
Start of MODEL 2
1 H GLU 1 H GLU 1 -9.279 -9.877 19.405
2 HA GLU 1 HA GLU 1 -10.766 -8.402 18.257
3 1HB GLU 1 1HB GLU 1 -8.011 -7.478 19.044
4 2HB GLU 1 2HB GLU 1 -9.073 -6.314 18.276
5 1HG GLU 1 1HG GLU 1 -9.898 -5.970 20.378
6 2HG GLU 1 2HG GLU 1 -10.799 -7.448 20.107
7 H ASN 2 H ASN 2 -7.456 -8.400 16.741
8 HA ASN 2 HA ASN 2 -8.504 -8.731 14.185
9 1HB ASN 2 1HB ASN 2 -7.944 -6.493 13.222
10 2HB ASN 2 2HB ASN 2 -9.212 -6.361 14.425
11 1HD2 ASN 2 2HD2 ASN 2 -7.704 -4.204 13.664
12 2HD2 ASN 2 1HD2 ASN 2 -6.693 -3.670 14.965
13 H PHE 3 H PHE 3 -6.622 -8.435 12.505
14 HA PHE 3 HA PHE 3 -4.000 -8.234 13.705
15 1HB PHE 3 1HB PHE 3 -5.119 -10.692 13.705
16 2HB PHE 3 2HB PHE 3 -4.721 -10.660 11.998
17 HD1 PHE 3 HD1 PHE 3 -3.146 -10.150 15.340
18 HD2 PHE 3 HD2 PHE 3 -2.625 -11.373 11.309
19 HE1 PHE 3 HE1 PHE 3 -0.811 -10.901 15.869
20 HE2 PHE 3 HE2 PHE 3 -0.290 -12.124 11.839
21 HZ PHE 3 HZ PHE 3 0.590 -11.879 14.113
22 H ASN 4 H ASN 4 -3.373 -6.543 12.378
23 HA ASN 4 HA ASN 4 -3.028 -7.257 9.622
24 1HB ASN 4 1HB ASN 4 -5.246 -6.141 9.588
25 2HB ASN 4 2HB ASN 4 -4.609 -4.781 10.491
26 1HD2 ASN 4 2HD2 ASN 4 -4.211 -3.073 9.333
27 2HD2 ASN 4 1HD2 ASN 4 -3.679 -3.012 7.686
28 H GLY 5 H GLY 5 -1.091 -7.038 11.630
29 1HA GLY 5 1HA GLY 5 1.043 -6.030 11.361
30 2HA GLY 5 2HA GLY 5 0.272 -4.524 10.908
31 H GLY 6 H GLY 6 -1.807 -4.513 12.970
32 1HA GLY 6 1HA GLY 6 -1.600 -4.834 15.469
33 2HA GLY 6 2HA GLY 6 -0.097 -3.945 15.313
34 H CYS 7 H CYS 7 -3.378 -3.534 13.792
35 HA CYS 7 HA CYS 7 -3.254 -0.749 14.678
36 1HB CYS 7 1HB CYS 7 -4.670 -2.057 12.356
37 2HB CYS 7 2HB CYS 7 -5.052 -0.436 12.902
38 H LEU 8 H LEU 8 -5.830 0.044 14.752
39 HA LEU 8 HA LEU 8 -6.913 -1.564 16.893
40 1HB LEU 8 1HB LEU 8 -6.774 0.783 17.257
41 2HB LEU 8 2HB LEU 8 -7.588 1.140 15.746
42 HG LEU 8 HG LEU 8 -9.691 0.329 16.589
43 1HD1 LEU 8 1HD1 LEU 8 -8.017 -1.078 18.496
44 2HD1 LEU 8 2HD1 LEU 8 -9.333 -0.196 19.307
45 3HD1 LEU 8 3HD1 LEU 8 -9.707 -1.370 18.022
46 1HD2 LEU 8 1HD2 LEU 8 -8.308 2.114 18.608
47 2HD2 LEU 8 2HD2 LEU 8 -9.161 2.625 17.132
48 3HD2 LEU 8 3HD2 LEU 8 -10.066 1.883 18.472
49 H ALA 9 H ALA 9 -8.069 -0.215 13.723
50 HA ALA 9 HA ALA 9 -9.097 -2.415 12.630
51 1HB ALA 9 1HB ALA 9 -10.673 -1.669 15.006
52 2HB ALA 9 2HB ALA 9 -11.651 -1.834 13.528
53 3HB ALA 9 3HB ALA 9 -10.645 -3.192 14.086
54 H GLY 10 H GLY 10 -8.714 -1.273 10.739
55 1HA GLY 10 1HA GLY 10 -10.130 -0.139 9.086
56 2HA GLY 10 2HA GLY 10 -10.454 1.081 10.301
57 H TYR 11 H TYR 11 -7.728 1.152 11.438
58 HA TYR 11 HA TYR 11 -6.621 3.092 9.758
59 1HB TYR 11 1HB TYR 11 -5.539 1.285 12.007
60 2HB TYR 11 2HB TYR 11 -4.646 2.664 11.398
61 HD1 TYR 11 HD1 TYR 11 -5.730 4.991 11.601
62 HD2 TYR 11 HD2 TYR 11 -7.158 1.549 13.706
63 HE1 TYR 11 HE1 TYR 11 -6.937 6.495 13.259
64 HE2 TYR 11 HE2 TYR 11 -8.359 3.065 15.356
65 HH TYR 11 HH TYR 11 -7.829 6.497 15.365
66 H MET 12 H MET 12 -4.520 3.082 8.655
67 HA MET 12 HA MET 12 -3.956 0.422 7.591
68 1HB MET 12 1HB MET 12 -3.061 1.792 5.582
69 2HB MET 12 2HB MET 12 -4.797 1.839 5.814
70 1HG MET 12 1HG MET 12 -4.797 4.077 6.318
71 2HG MET 12 2HG MET 12 -3.380 3.947 7.340
72 1HE MET 12 1HE MET 12 -3.746 6.359 5.877
73 2HE MET 12 2HE MET 12 -2.860 6.611 4.353
74 3HE MET 12 3HE MET 12 -4.470 5.853 4.331
75 H ARG 13 H ARG 13 -1.607 0.197 6.745
76 HA ARG 13 HA ARG 13 0.091 1.371 8.779
77 1HB ARG 13 1HB ARG 13 0.429 -1.085 6.991
78 2HB ARG 13 2HB ARG 13 1.706 -0.490 8.033
79 1HG ARG 13 1HG ARG 13 -1.021 -0.972 9.243
80 2HG ARG 13 2HG ARG 13 -0.017 -2.362 8.878
81 1HD ARG 13 1HD ARG 13 1.677 -0.425 10.161
82 2HD ARG 13 2HD ARG 13 0.202 -0.514 11.102
83 HE ARG 13 HE ARG 13 0.703 -2.746 11.679
84 1HH1 ARG 13 1HH1 ARG 13 2.877 -1.634 9.146
85 2HH1 ARG 13 2HH1 ARG 13 3.935 -2.998 9.279
86 1HH2 ARG 13 1HH2 ARG 13 2.099 -4.546 11.855
87 2HH2 ARG 13 2HH2 ARG 13 3.490 -4.666 10.830
88 H THR 14 H THR 14 1.024 3.264 8.026
89 HA THR 14 HA THR 14 1.414 3.822 5.299
90 HB THR 14 HB THR 14 2.574 5.813 6.209
91 HG1 THR 14 HG1 THR 14 3.008 5.697 8.573
92 1HG2 THR 14 1HG2 THR 14 -0.031 5.314 6.744
93 2HG2 THR 14 2HG2 THR 14 0.590 5.245 8.411
94 3HG2 THR 14 3HG2 THR 14 0.803 6.723 7.441
95 H ALA 15 H ALA 15 4.113 4.913 5.379
96 HA ALA 15 HA ALA 15 5.494 2.401 4.844
97 1HB ALA 15 1HB ALA 15 5.720 5.258 3.932
98 2HB ALA 15 2HB ALA 15 7.164 4.219 3.863
99 3HB ALA 15 3HB ALA 15 5.692 3.758 2.974
100 H ASP 16 H ASP 16 4.928 4.058 7.539
101 HA ASP 16 HA ASP 16 7.723 4.013 8.367
102 1HB ASP 16 1HB ASP 16 5.902 6.085 8.573
103 2HB ASP 16 2HB ASP 16 5.698 5.312 10.131
104 H GLY 17 H GLY 17 4.556 2.603 8.616
105 1HA GLY 17 1HA GLY 17 4.148 0.568 9.670
106 2HA GLY 17 2HA GLY 17 5.459 0.866 10.794
107 H ARG 18 H ARG 18 3.766 3.776 10.459
108 HA ARG 18 HA ARG 18 2.557 3.348 13.012
109 1HB ARG 18 1HB ARG 18 2.608 5.838 11.232
110 2HB ARG 18 2HB ARG 18 2.079 5.804 12.903
111 1HG ARG 18 1HG ARG 18 4.349 5.068 13.623
112 2HG ARG 18 2HG ARG 18 4.885 5.049 11.955
113 1HD ARG 18 1HD ARG 18 5.099 7.339 11.857
114 2HD ARG 18 2HD ARG 18 3.634 7.620 12.777
115 HE ARG 18 HE ARG 18 4.959 7.853 14.676
116 1HH1 ARG 18 1HH1 ARG 18 6.677 5.824 12.370
117 2HH1 ARG 18 2HH1 ARG 18 8.091 5.677 13.359
118 1HH2 ARG 18 1HH2 ARG 18 6.826 7.660 15.981
119 2HH2 ARG 18 2HH2 ARG 18 8.177 6.728 15.426
120 H CYS 19 H CYS 19 0.495 2.516 13.146
121 HA CYS 19 HA CYS 19 -1.168 2.154 11.000
122 1HB CYS 19 1HB CYS 19 -1.780 2.343 13.951
123 2HB CYS 19 2HB CYS 19 -2.979 1.898 12.754
124 H LYS 20 H LYS 20 -1.773 3.864 9.675
125 HA LYS 20 HA LYS 20 -2.576 6.351 10.972
126 1HB LYS 20 1HB LYS 20 -1.436 5.600 8.341
127 2HB LYS 20 2HB LYS 20 -2.642 6.871 8.302
128 1HG LYS 20 1HG LYS 20 -1.010 7.490 10.539
129 2HG LYS 20 2HG LYS 20 0.112 6.966 9.299
130 1HD LYS 20 1HD LYS 20 -1.746 8.623 7.939
131 2HD LYS 20 2HD LYS 20 -1.442 9.445 9.457
132 1HE LYS 20 1HE LYS 20 1.106 8.929 8.924
133 2HE LYS 20 2HE LYS 20 0.537 8.703 7.282
134 1HZ LYS 20 1HZ LYS 20 -0.393 11.073 8.635
135 2HZ LYS 20 2HZ LYS 20 1.194 11.042 8.247
136 3HZ LYS 20 3HZ LYS 20 0.064 10.872 7.080
137 HA PRO 21 HA PRO 21 -6.752 5.763 10.048
138 1HB PRO 21 1HB PRO 21 -7.646 8.232 9.290
139 2HB PRO 21 2HB PRO 21 -7.368 7.785 10.961
140 1HG PRO 21 1HG PRO 21 -5.727 9.507 9.205
141 2HG PRO 21 2HG PRO 21 -5.711 9.389 10.954
142 1HD PRO 21 1HD PRO 21 -3.795 8.263 9.140
143 2HD PRO 21 2HD PRO 21 -3.844 8.049 10.878
144 H THR 22 H THR 22 -8.253 5.059 8.560
145 HA THR 22 HA THR 22 -7.319 5.472 5.796
146 HB THR 22 HB THR 22 -8.969 3.138 6.871
147 HG1 THR 22 HG1 THR 22 -7.043 2.507 7.755
148 1HG2 THR 22 1HG2 THR 22 -7.247 3.679 4.411
149 2HG2 THR 22 2HG2 THR 22 -7.580 2.018 4.961
150 3HG2 THR 22 3HG2 THR 22 -8.922 3.080 4.469
151 H PHE 23 H PHE 23 -9.391 6.827 7.856
152 HA PHE 23 HA PHE 23 -11.696 6.690 6.075
153 1HB PHE 23 1HB PHE 23 -12.722 7.979 8.044
154 2HB PHE 23 2HB PHE 23 -12.100 6.404 8.493
155 HD1 PHE 23 HD1 PHE 23 -10.940 9.949 8.280
156 HD2 PHE 23 HD2 PHE 23 -10.778 6.263 10.375
157 HE1 PHE 23 HE1 PHE 23 -9.511 11.016 10.046
158 HE2 PHE 23 HE2 PHE 23 -9.349 7.330 12.142
159 HZ PHE 23 HZ PHE 23 -8.732 9.693 11.957
Start of MODEL 3
1 H GLU 1 H GLU 1 -4.324 -12.529 19.088
2 HA GLU 1 HA GLU 1 -3.193 -10.457 19.452
3 1HB GLU 1 1HB GLU 1 -1.811 -12.940 18.619
4 2HB GLU 1 2HB GLU 1 -0.794 -11.516 18.528
5 1HG GLU 1 1HG GLU 1 -1.619 -10.951 20.919
6 2HG GLU 1 2HG GLU 1 -2.292 -12.569 20.965
7 H ASN 2 H ASN 2 -2.446 -11.856 16.177
8 HA ASN 2 HA ASN 2 -1.538 -9.270 15.333
9 1HB ASN 2 1HB ASN 2 -0.994 -10.448 13.198
10 2HB ASN 2 2HB ASN 2 -0.338 -11.312 14.573
11 1HD2 ASN 2 2HD2 ASN 2 -1.294 -12.058 11.796
12 2HD2 ASN 2 1HD2 ASN 2 -2.346 -13.415 12.020
13 H PHE 3 H PHE 3 -2.515 -8.195 13.381
14 HA PHE 3 HA PHE 3 -5.143 -9.158 12.615
15 1HB PHE 3 1HB PHE 3 -5.603 -7.660 14.517
16 2HB PHE 3 2HB PHE 3 -4.421 -6.494 13.956
17 HD1 PHE 3 HD1 PHE 3 -7.767 -7.896 13.317
18 HD2 PHE 3 HD2 PHE 3 -4.991 -4.842 12.330
19 HE1 PHE 3 HE1 PHE 3 -9.576 -6.641 12.111
20 HE2 PHE 3 HE2 PHE 3 -6.799 -3.587 11.125
21 HZ PHE 3 HZ PHE 3 -9.071 -4.502 11.030
22 H ASN 4 H ASN 4 -2.616 -6.578 12.318
23 HA ASN 4 HA ASN 4 -2.329 -7.007 9.603
24 1HB ASN 4 1HB ASN 4 -4.549 -5.921 9.381
25 2HB ASN 4 2HB ASN 4 -4.020 -4.566 10.357
26 1HD2 ASN 4 2HD2 ASN 4 -3.564 -2.834 9.256
27 2HD2 ASN 4 1HD2 ASN 4 -2.881 -2.739 7.668
28 H GLY 5 H GLY 5 -0.571 -6.790 11.763
29 1HA GLY 5 1HA GLY 5 1.562 -5.746 11.691
30 2HA GLY 5 2HA GLY 5 0.806 -4.244 11.197
31 H GLY 6 H GLY 6 -1.437 -4.297 13.077
32 1HA GLY 6 1HA GLY 6 -1.422 -4.662 15.583
33 2HA GLY 6 2HA GLY 6 0.061 -3.727 15.558
34 H CYS 7 H CYS 7 -3.150 -3.423 13.866
35 HA CYS 7 HA CYS 7 -3.145 -0.624 14.713
36 1HB CYS 7 1HB CYS 7 -4.400 -2.025 12.358
37 2HB CYS 7 2HB CYS 7 -4.930 -0.437 12.877
38 H LEU 8 H LEU 8 -5.693 0.131 14.785
39 HA LEU 8 HA LEU 8 -6.796 -1.461 16.907
40 1HB LEU 8 1HB LEU 8 -6.785 0.898 17.178
41 2HB LEU 8 2HB LEU 8 -7.548 1.159 15.622
42 HG LEU 8 HG LEU 8 -9.624 0.107 16.472
43 1HD1 LEU 8 1HD1 LEU 8 -8.023 -0.999 18.416
44 2HD1 LEU 8 2HD1 LEU 8 -8.890 0.278 19.303
45 3HD1 LEU 8 3HD1 LEU 8 -9.803 -0.970 18.420
46 1HD2 LEU 8 1HD2 LEU 8 -8.548 2.650 17.126
47 2HD2 LEU 8 2HD2 LEU 8 -10.254 2.177 16.947
48 3HD2 LEU 8 3HD2 LEU 8 -9.465 2.077 18.539
49 H ALA 9 H ALA 9 -7.946 -0.290 13.662
50 HA ALA 9 HA ALA 9 -8.828 -2.577 12.622
51 1HB ALA 9 1HB ALA 9 -10.498 -1.845 14.943
52 2HB ALA 9 2HB ALA 9 -11.426 -2.136 13.453
53 3HB ALA 9 3HB ALA 9 -10.346 -3.398 14.088
54 H GLY 10 H GLY 10 -8.359 -1.348 10.767
55 1HA GLY 10 1HA GLY 10 -9.849 -0.382 9.032
56 2HA GLY 10 2HA GLY 10 -10.266 0.846 10.210
57 H TYR 11 H TYR 11 -7.644 1.201 11.416
58 HA TYR 11 HA TYR 11 -6.595 3.162 9.801
59 1HB TYR 11 1HB TYR 11 -5.424 1.280 11.939
60 2HB TYR 11 2HB TYR 11 -4.534 2.671 11.350
61 HD1 TYR 11 HD1 TYR 11 -5.269 4.962 11.897
62 HD2 TYR 11 HD2 TYR 11 -7.322 1.540 13.437
63 HE1 TYR 11 HE1 TYR 11 -6.424 6.425 13.627
64 HE2 TYR 11 HE2 TYR 11 -8.469 3.013 15.162
65 HH TYR 11 HH TYR 11 -9.082 5.355 15.404
66 H MET 12 H MET 12 -4.502 3.303 8.669
67 HA MET 12 HA MET 12 -3.945 0.770 7.337
68 1HB MET 12 1HB MET 12 -2.886 2.458 5.602
69 2HB MET 12 2HB MET 12 -4.633 2.340 5.678
70 1HG MET 12 1HG MET 12 -4.789 4.350 7.057
71 2HG MET 12 2HG MET 12 -3.052 4.401 7.282
72 1HE MET 12 1HE MET 12 -2.009 6.122 6.450
73 2HE MET 12 2HE MET 12 -2.202 6.965 4.894
74 3HE MET 12 3HE MET 12 -3.404 7.196 6.186
75 H ARG 13 H ARG 13 -1.635 0.398 6.651
76 HA ARG 13 HA ARG 13 0.071 1.297 8.800
77 1HB ARG 13 1HB ARG 13 -0.295 -1.194 7.569
78 2HB ARG 13 2HB ARG 13 1.205 -0.635 6.855
79 1HG ARG 13 1HG ARG 13 1.573 0.019 9.534
80 2HG ARG 13 2HG ARG 13 0.637 -1.458 9.652
81 1HD ARG 13 1HD ARG 13 2.295 -2.527 8.009
82 2HD ARG 13 2HD ARG 13 3.277 -1.084 8.163
83 HE ARG 13 HE ARG 13 2.577 -2.196 10.762
84 1HH1 ARG 13 1HH1 ARG 13 4.801 -2.506 8.053
85 2HH1 ARG 13 2HH1 ARG 13 6.050 -3.246 8.997
86 1HH2 ARG 13 1HH2 ARG 13 4.225 -3.172 12.009
87 2HH2 ARG 13 2HH2 ARG 13 5.720 -3.628 11.263
88 H THR 14 H THR 14 1.119 3.218 8.320
89 HA THR 14 HA THR 14 1.585 4.136 5.716
90 HB THR 14 HB THR 14 3.183 5.705 7.073
91 HG1 THR 14 HG1 THR 14 3.572 4.764 9.039
92 1HG2 THR 14 1HG2 THR 14 0.446 5.793 6.794
93 2HG2 THR 14 2HG2 THR 14 0.587 5.635 8.561
94 3HG2 THR 14 3HG2 THR 14 1.373 6.995 7.725
95 H ALA 15 H ALA 15 4.230 4.988 5.594
96 HA ALA 15 HA ALA 15 5.442 2.539 4.705
97 1HB ALA 15 1HB ALA 15 6.168 5.483 4.585
98 2HB ALA 15 2HB ALA 15 7.260 4.208 3.995
99 3HB ALA 15 3HB ALA 15 5.654 4.417 3.256
100 H ASP 16 H ASP 16 5.106 3.938 7.701
101 HA ASP 16 HA ASP 16 7.760 3.015 8.483
102 1HB ASP 16 1HB ASP 16 6.734 5.550 8.837
103 2HB ASP 16 2HB ASP 16 6.232 4.794 10.335
104 H GLY 17 H GLY 17 4.455 2.354 8.438
105 1HA GLY 17 1HA GLY 17 3.544 0.440 9.425
106 2HA GLY 17 2HA GLY 17 4.675 0.570 10.757
107 H ARG 18 H ARG 18 3.999 3.689 10.607
108 HA ARG 18 HA ARG 18 2.450 3.788 12.800
109 1HB ARG 18 1HB ARG 18 2.353 5.855 10.549
110 2HB ARG 18 2HB ARG 18 2.065 6.155 12.251
111 1HG ARG 18 1HG ARG 18 4.608 4.909 12.169
112 2HG ARG 18 2HG ARG 18 4.611 6.004 10.801
113 1HD ARG 18 1HD ARG 18 3.779 7.842 12.379
114 2HD ARG 18 2HD ARG 18 4.021 6.728 13.710
115 HE ARG 18 HE ARG 18 6.115 8.082 12.155
116 1HH1 ARG 18 1HH1 ARG 18 5.378 5.419 14.333
117 2HH1 ARG 18 2HH1 ARG 18 7.012 5.244 14.878
118 1HH2 ARG 18 1HH2 ARG 18 8.272 7.852 12.874
119 2HH2 ARG 18 2HH2 ARG 18 8.670 6.637 14.043
120 H CYS 19 H CYS 19 0.418 2.925 13.117
121 HA CYS 19 HA CYS 19 -1.302 2.289 11.029
122 1HB CYS 19 1HB CYS 19 -1.790 2.608 13.993
123 2HB CYS 19 2HB CYS 19 -3.007 2.028 12.873
124 H LYS 20 H LYS 20 -1.625 4.145 9.677
125 HA LYS 20 HA LYS 20 -2.614 6.566 10.899
126 1HB LYS 20 1HB LYS 20 -1.434 5.765 8.337
127 2HB LYS 20 2HB LYS 20 -2.789 6.859 8.147
128 1HG LYS 20 1HG LYS 20 -1.516 8.096 10.223
129 2HG LYS 20 2HG LYS 20 -0.135 7.330 9.463
130 1HD LYS 20 1HD LYS 20 -0.860 8.344 7.249
131 2HD LYS 20 2HD LYS 20 -2.132 9.197 8.100
132 1HE LYS 20 1HE LYS 20 -0.630 10.612 9.230
133 2HE LYS 20 2HE LYS 20 0.693 9.466 9.134
134 1HZ LYS 20 1HZ LYS 20 0.108 10.017 6.553
135 2HZ LYS 20 2HZ LYS 20 -0.064 11.467 7.285
136 3HZ LYS 20 3HZ LYS 20 1.346 10.652 7.408
137 HA PRO 21 HA PRO 21 -6.804 5.873 10.123
138 1HB PRO 21 1HB PRO 21 -7.764 8.270 9.231
139 2HB PRO 21 2HB PRO 21 -7.429 7.941 10.919
140 1HG PRO 21 1HG PRO 21 -5.873 9.568 9.004
141 2HG PRO 21 2HG PRO 21 -5.803 9.568 10.755
142 1HD PRO 21 1HD PRO 21 -3.921 8.353 8.962
143 2HD PRO 21 2HD PRO 21 -3.915 8.255 10.712
144 H THR 22 H THR 22 -8.347 5.062 8.729
145 HA THR 22 HA THR 22 -7.479 5.270 5.922
146 HB THR 22 HB THR 22 -9.059 3.049 7.318
147 HG1 THR 22 HG1 THR 22 -6.280 3.199 6.403
148 1HG2 THR 22 1HG2 THR 22 -9.244 3.182 4.781
149 2HG2 THR 22 2HG2 THR 22 -7.469 3.074 4.700
150 3HG2 THR 22 3HG2 THR 22 -8.415 1.716 5.356
151 H PHE 23 H PHE 23 -9.481 6.819 7.907
152 HA PHE 23 HA PHE 23 -11.802 6.607 6.145
153 1HB PHE 23 1HB PHE 23 -12.813 7.987 8.078
154 2HB PHE 23 2HB PHE 23 -12.259 6.392 8.547
155 HD1 PHE 23 HD1 PHE 23 -10.907 9.868 8.285
156 HD2 PHE 23 HD2 PHE 23 -11.012 6.235 10.476
157 HE1 PHE 23 HE1 PHE 23 -9.455 10.894 10.057
158 HE2 PHE 23 HE2 PHE 23 -9.560 7.261 12.247
159 HZ PHE 23 HZ PHE 23 -8.799 9.579 12.017
Start of MODEL 4
1 H GLU 1 H GLU 1 -5.093 -6.856 20.990
2 HA GLU 1 HA GLU 1 -4.138 -8.472 19.512
3 1HB GLU 1 1HB GLU 1 -6.864 -7.422 19.285
4 2HB GLU 1 2HB GLU 1 -6.357 -8.182 17.790
5 1HG GLU 1 1HG GLU 1 -7.055 -10.099 18.855
6 2HG GLU 1 2HG GLU 1 -5.438 -10.057 19.529
7 H ASN 2 H ASN 2 -2.218 -7.701 18.456
8 HA ASN 2 HA ASN 2 -2.596 -6.029 16.154
9 1HB ASN 2 1HB ASN 2 -0.046 -7.339 17.235
10 2HB ASN 2 2HB ASN 2 -0.108 -6.066 16.033
11 1HD2 ASN 2 2HD2 ASN 2 1.125 -6.201 18.706
12 2HD2 ASN 2 1HD2 ASN 2 0.521 -4.851 19.608
13 H PHE 3 H PHE 3 -2.275 -6.767 13.972
14 HA PHE 3 HA PHE 3 -1.500 -9.554 13.627
15 1HB PHE 3 1HB PHE 3 -4.123 -8.968 13.765
16 2HB PHE 3 2HB PHE 3 -3.875 -8.310 12.160
17 HD1 PHE 3 HD1 PHE 3 -2.938 -9.866 10.365
18 HD2 PHE 3 HD2 PHE 3 -4.452 -11.270 14.072
19 HE1 PHE 3 HE1 PHE 3 -3.224 -12.158 9.380
20 HE2 PHE 3 HE2 PHE 3 -4.737 -13.561 13.089
21 HZ PHE 3 HZ PHE 3 -4.120 -13.978 10.754
22 H ASN 4 H ASN 4 -2.565 -6.497 11.974
23 HA ASN 4 HA ASN 4 -0.604 -7.125 9.920
24 1HB ASN 4 1HB ASN 4 -1.914 -5.149 8.731
25 2HB ASN 4 2HB ASN 4 -2.647 -6.740 8.796
26 1HD2 ASN 4 2HD2 ASN 4 -3.006 -3.487 9.467
27 2HD2 ASN 4 1HD2 ASN 4 -4.409 -3.528 10.482
28 H GLY 5 H GLY 5 0.689 -6.266 12.116
29 1HA GLY 5 1HA GLY 5 2.383 -4.576 12.170
30 2HA GLY 5 2HA GLY 5 1.209 -3.401 11.613
31 H GLY 6 H GLY 6 -1.029 -4.183 13.292
32 1HA GLY 6 1HA GLY 6 -1.360 -4.528 15.684
33 2HA GLY 6 2HA GLY 6 0.047 -3.523 15.970
34 H CYS 7 H CYS 7 -2.976 -3.297 13.945
35 HA CYS 7 HA CYS 7 -3.168 -0.514 14.798
36 1HB CYS 7 1HB CYS 7 -4.463 -1.998 12.504
37 2HB CYS 7 2HB CYS 7 -4.842 -0.343 12.939
38 H LEU 8 H LEU 8 -5.776 0.089 14.784
39 HA LEU 8 HA LEU 8 -6.828 -1.562 16.910
40 1HB LEU 8 1HB LEU 8 -6.856 0.790 17.252
41 2HB LEU 8 2HB LEU 8 -7.626 1.083 15.706
42 HG LEU 8 HG LEU 8 -9.674 -0.064 16.533
43 1HD1 LEU 8 1HD1 LEU 8 -8.124 -1.234 18.395
44 2HD1 LEU 8 2HD1 LEU 8 -8.788 0.109 19.358
45 3HD1 LEU 8 3HD1 LEU 8 -9.887 -1.041 18.558
46 1HD2 LEU 8 1HD2 LEU 8 -8.577 2.409 17.819
47 2HD2 LEU 8 2HD2 LEU 8 -9.909 2.218 16.654
48 3HD2 LEU 8 3HD2 LEU 8 -10.147 1.765 18.359
49 H ALA 9 H ALA 9 -7.952 -0.321 13.683
50 HA ALA 9 HA ALA 9 -8.799 -2.596 12.584
51 1HB ALA 9 1HB ALA 9 -10.508 -1.919 14.888
52 2HB ALA 9 2HB ALA 9 -11.415 -2.170 13.377
53 3HB ALA 9 3HB ALA 9 -10.346 -3.451 13.996
54 H GLY 10 H GLY 10 -8.443 -1.476 10.679
55 1HA GLY 10 1HA GLY 10 -9.858 -0.446 8.967
56 2HA GLY 10 2HA GLY 10 -10.301 0.768 10.151
57 H TYR 11 H TYR 11 -7.693 1.128 11.393
58 HA TYR 11 HA TYR 11 -6.639 3.100 9.775
59 1HB TYR 11 1HB TYR 11 -5.491 1.279 11.978
60 2HB TYR 11 2HB TYR 11 -4.632 2.695 11.403
61 HD1 TYR 11 HD1 TYR 11 -5.810 4.985 11.625
62 HD2 TYR 11 HD2 TYR 11 -7.096 1.466 13.692
63 HE1 TYR 11 HE1 TYR 11 -7.068 6.421 13.303
64 HE2 TYR 11 HE2 TYR 11 -8.349 2.915 15.363
65 HH TYR 11 HH TYR 11 -9.298 5.064 15.524
66 H MET 12 H MET 12 -4.524 3.250 8.695
67 HA MET 12 HA MET 12 -3.844 0.681 7.493
68 1HB MET 12 1HB MET 12 -2.829 2.388 5.699
69 2HB MET 12 2HB MET 12 -4.547 2.046 5.695
70 1HG MET 12 1HG MET 12 -5.080 4.099 6.822
71 2HG MET 12 2HG MET 12 -3.426 4.343 7.345
72 1HE MET 12 1HE MET 12 -3.836 6.571 6.744
73 2HE MET 12 2HE MET 12 -2.299 6.650 5.851
74 3HE MET 12 3HE MET 12 -3.788 7.289 5.115
75 H ARG 13 H ARG 13 -1.532 0.322 6.934
76 HA ARG 13 HA ARG 13 0.111 1.544 8.972
77 1HB ARG 13 1HB ARG 13 1.700 -0.332 8.463
78 2HB ARG 13 2HB ARG 13 0.107 -0.918 8.900
79 1HG ARG 13 1HG ARG 13 0.014 -2.051 6.941
80 2HG ARG 13 2HG ARG 13 0.020 -0.524 6.081
81 1HD ARG 13 1HD ARG 13 2.382 -0.556 5.770
82 2HD ARG 13 2HD ARG 13 2.637 -1.697 7.076
83 HE ARG 13 HE ARG 13 2.263 -3.443 5.572
84 1HH1 ARG 13 1HH1 ARG 13 0.860 -0.497 4.255
85 2HH1 ARG 13 2HH1 ARG 13 0.441 -1.223 2.738
86 1HH2 ARG 13 1HH2 ARG 13 1.711 -4.401 3.572
87 2HH2 ARG 13 2HH2 ARG 13 0.928 -3.458 2.348
88 H THR 14 H THR 14 1.058 3.441 8.238
89 HA THR 14 HA THR 14 1.521 4.064 5.570
90 HB THR 14 HB THR 14 2.988 5.857 6.624
91 HG1 THR 14 HG1 THR 14 3.553 5.489 8.765
92 1HG2 THR 14 1HG2 THR 14 0.299 5.207 7.924
93 2HG2 THR 14 2HG2 THR 14 1.219 6.677 8.327
94 3HG2 THR 14 3HG2 THR 14 0.631 6.422 6.667
95 H ALA 15 H ALA 15 4.201 4.941 5.416
96 HA ALA 15 HA ALA 15 5.401 2.432 4.682
97 1HB ALA 15 1HB ALA 15 5.400 4.934 3.599
98 2HB ALA 15 2HB ALA 15 6.941 4.969 4.489
99 3HB ALA 15 3HB ALA 15 6.650 3.711 3.265
100 H ASP 16 H ASP 16 5.016 3.891 7.598
101 HA ASP 16 HA ASP 16 7.702 3.117 8.431
102 1HB ASP 16 1HB ASP 16 7.298 5.537 8.740
103 2HB ASP 16 2HB ASP 16 5.812 5.207 9.609
104 H GLY 17 H GLY 17 4.442 2.286 8.360
105 1HA GLY 17 1HA GLY 17 3.560 0.403 9.390
106 2HA GLY 17 2HA GLY 17 4.721 0.545 10.694
107 H ARG 18 H ARG 18 3.960 3.661 10.523
108 HA ARG 18 HA ARG 18 2.460 3.714 12.771
109 1HB ARG 18 1HB ARG 18 2.478 5.773 10.505
110 2HB ARG 18 2HB ARG 18 1.945 6.097 12.142
111 1HG ARG 18 1HG ARG 18 4.247 5.430 12.972
112 2HG ARG 18 2HG ARG 18 4.759 5.252 11.306
113 1HD ARG 18 1HD ARG 18 4.979 7.510 11.016
114 2HD ARG 18 2HD ARG 18 3.432 7.845 11.766
115 HE ARG 18 HE ARG 18 5.112 7.086 13.881
116 1HH1 ARG 18 1HH1 ARG 18 5.104 9.604 11.423
117 2HH1 ARG 18 2HH1 ARG 18 5.972 10.740 12.402
118 1HH2 ARG 18 1HH2 ARG 18 6.257 8.584 15.173
119 2HH2 ARG 18 2HH2 ARG 18 6.632 10.156 14.549
120 H CYS 19 H CYS 19 0.420 2.892 13.122
121 HA CYS 19 HA CYS 19 -1.319 2.283 11.019
122 1HB CYS 19 1HB CYS 19 -1.793 2.488 13.998
123 2HB CYS 19 2HB CYS 19 -2.979 1.887 12.856
124 H LYS 20 H LYS 20 -1.685 4.192 9.758
125 HA LYS 20 HA LYS 20 -2.749 6.512 11.137
126 1HB LYS 20 1HB LYS 20 -1.438 5.959 8.560
127 2HB LYS 20 2HB LYS 20 -2.781 7.078 8.440
128 1HG LYS 20 1HG LYS 20 -1.574 8.069 10.685
129 2HG LYS 20 2HG LYS 20 -0.172 7.386 9.884
130 1HD LYS 20 1HD LYS 20 -1.185 8.631 7.741
131 2HD LYS 20 2HD LYS 20 -1.999 9.606 8.949
132 1HE LYS 20 1HE LYS 20 0.373 9.844 10.054
133 2HE LYS 20 2HE LYS 20 0.991 9.266 8.519
134 1HZ LYS 20 1HZ LYS 20 -0.455 11.080 7.535
135 2HZ LYS 20 2HZ LYS 20 -0.532 11.703 9.042
136 3HZ LYS 20 3HZ LYS 20 0.913 11.543 8.298
137 HA PRO 21 HA PRO 21 -6.865 5.777 10.058
138 1HB PRO 21 1HB PRO 21 -7.849 8.216 9.313
139 2HB PRO 21 2HB PRO 21 -7.600 7.753 10.985
140 1HG PRO 21 1HG PRO 21 -5.989 9.578 9.308
141 2HG PRO 21 2HG PRO 21 -6.019 9.431 11.054
142 1HD PRO 21 1HD PRO 21 -4.002 8.423 9.282
143 2HD PRO 21 2HD PRO 21 -4.093 8.177 11.015
144 H THR 22 H THR 22 -8.314 5.066 8.511
145 HA THR 22 HA THR 22 -7.235 5.433 5.799
146 HB THR 22 HB THR 22 -9.137 3.269 6.821
147 HG1 THR 22 HG1 THR 22 -7.295 2.698 7.920
148 1HG2 THR 22 1HG2 THR 22 -7.197 3.523 4.467
149 2HG2 THR 22 2HG2 THR 22 -7.915 1.976 4.977
150 3HG2 THR 22 3HG2 THR 22 -8.960 3.290 4.382
151 H PHE 23 H PHE 23 -9.304 7.005 7.700
152 HA PHE 23 HA PHE 23 -11.457 7.069 5.723
153 1HB PHE 23 1HB PHE 23 -12.578 8.360 7.642
154 2HB PHE 23 2HB PHE 23 -12.135 6.719 8.064
155 HD1 PHE 23 HD1 PHE 23 -10.649 10.147 8.147
156 HD2 PHE 23 HD2 PHE 23 -11.062 6.390 10.076
157 HE1 PHE 23 HE1 PHE 23 -9.331 11.006 10.102
158 HE2 PHE 23 HE2 PHE 23 -9.743 7.248 12.031
159 HZ PHE 23 HZ PHE 23 -8.894 9.546 12.022
Start of MODEL 5
1 H GLU 1 H GLU 1 -12.575 -5.603 11.346
2 HA GLU 1 HA GLU 1 -12.390 -6.027 13.690
3 1HB GLU 1 1HB GLU 1 -13.402 -7.850 11.729
4 2HB GLU 1 2HB GLU 1 -12.668 -8.825 12.987
5 1HG GLU 1 1HG GLU 1 -14.821 -8.531 13.856
6 2HG GLU 1 2HG GLU 1 -13.966 -7.219 14.642
7 H ASN 2 H ASN 2 -10.471 -8.454 11.766
8 HA ASN 2 HA ASN 2 -9.002 -9.168 14.082
9 1HB ASN 2 1HB ASN 2 -8.481 -9.798 11.128
10 2HB ASN 2 2HB ASN 2 -7.709 -10.602 12.479
11 1HD2 ASN 2 2HD2 ASN 2 -9.044 -12.052 10.632
12 2HD2 ASN 2 1HD2 ASN 2 -10.503 -12.722 11.280
13 H PHE 3 H PHE 3 -6.677 -8.752 14.402
14 HA PHE 3 HA PHE 3 -5.872 -6.176 13.692
15 1HB PHE 3 1HB PHE 3 -3.618 -7.171 14.580
16 2HB PHE 3 2HB PHE 3 -4.982 -7.244 15.679
17 HD1 PHE 3 HD1 PHE 3 -2.896 -9.224 13.373
18 HD2 PHE 3 HD2 PHE 3 -5.898 -9.336 16.370
19 HE1 PHE 3 HE1 PHE 3 -2.599 -11.707 13.576
20 HE2 PHE 3 HE2 PHE 3 -5.602 -11.821 16.573
21 HZ PHE 3 HZ PHE 3 -3.956 -12.977 15.173
22 H ASN 4 H ASN 4 -4.742 -5.351 11.975
23 HA ASN 4 HA ASN 4 -3.859 -7.320 10.025
24 1HB ASN 4 1HB ASN 4 -3.859 -5.161 8.506
25 2HB ASN 4 2HB ASN 4 -5.396 -5.893 8.917
26 1HD2 ASN 4 2HD2 ASN 4 -3.389 -3.152 9.141
27 2HD2 ASN 4 1HD2 ASN 4 -4.404 -2.130 10.103
28 H GLY 5 H GLY 5 -1.994 -7.248 11.902
29 1HA GLY 5 1HA GLY 5 0.361 -6.937 11.539
30 2HA GLY 5 2HA GLY 5 0.034 -5.318 10.954
31 H GLY 6 H GLY 6 -1.911 -4.488 12.925
32 1HA GLY 6 1HA GLY 6 -1.591 -4.822 15.525
33 2HA GLY 6 2HA GLY 6 -0.088 -4.003 15.153
34 H CYS 7 H CYS 7 -3.478 -3.628 13.886
35 HA CYS 7 HA CYS 7 -3.248 -0.797 14.608
36 1HB CYS 7 1HB CYS 7 -4.594 -2.143 12.273
37 2HB CYS 7 2HB CYS 7 -5.053 -0.534 12.793
38 H LEU 8 H LEU 8 -5.654 0.154 14.854
39 HA LEU 8 HA LEU 8 -6.838 -1.355 16.960
40 1HB LEU 8 1HB LEU 8 -6.718 1.004 17.166
41 2HB LEU 8 2HB LEU 8 -7.489 1.260 15.614
42 HG LEU 8 HG LEU 8 -9.600 0.318 16.521
43 1HD1 LEU 8 1HD1 LEU 8 -7.958 -0.687 18.548
44 2HD1 LEU 8 2HD1 LEU 8 -8.946 0.569 19.332
45 3HD1 LEU 8 3HD1 LEU 8 -9.733 -0.764 18.455
46 1HD2 LEU 8 1HD2 LEU 8 -8.296 2.774 17.594
47 2HD2 LEU 8 2HD2 LEU 8 -9.744 2.588 16.576
48 3HD2 LEU 8 3HD2 LEU 8 -9.837 2.264 18.324
49 H ALA 9 H ALA 9 -7.996 -0.230 13.703
50 HA ALA 9 HA ALA 9 -9.002 -2.502 12.748
51 1HB ALA 9 1HB ALA 9 -10.592 -1.627 15.075
52 2HB ALA 9 2HB ALA 9 -11.560 -1.922 13.612
53 3HB ALA 9 3HB ALA 9 -10.524 -3.211 14.269
54 H GLY 10 H GLY 10 -8.590 -1.422 10.813
55 1HA GLY 10 1HA GLY 10 -10.006 -0.425 9.077
56 2HA GLY 10 2HA GLY 10 -10.413 0.836 10.224
57 H TYR 11 H TYR 11 -7.757 1.135 11.427
58 HA TYR 11 HA TYR 11 -6.687 3.058 9.759
59 1HB TYR 11 1HB TYR 11 -5.574 1.240 11.979
60 2HB TYR 11 2HB TYR 11 -4.645 2.584 11.345
61 HD1 TYR 11 HD1 TYR 11 -7.630 1.647 13.304
62 HD2 TYR 11 HD2 TYR 11 -5.182 4.874 11.927
63 HE1 TYR 11 HE1 TYR 11 -8.760 3.217 14.953
64 HE2 TYR 11 HE2 TYR 11 -6.320 6.434 13.581
65 HH TYR 11 HH TYR 11 -7.513 6.094 15.845
66 H MET 12 H MET 12 -4.564 3.129 8.663
67 HA MET 12 HA MET 12 -3.997 0.531 7.462
68 1HB MET 12 1HB MET 12 -3.015 2.081 5.586
69 2HB MET 12 2HB MET 12 -4.760 1.999 5.728
70 1HG MET 12 1HG MET 12 -4.820 4.104 6.995
71 2HG MET 12 2HG MET 12 -3.070 4.150 7.091
72 1HE MET 12 1HE MET 12 -3.425 6.361 6.545
73 2HE MET 12 2HE MET 12 -2.702 6.780 4.974
74 3HE MET 12 3HE MET 12 -4.454 6.970 5.226
75 H ARG 13 H ARG 13 -1.657 0.264 6.689
76 HA ARG 13 HA ARG 13 0.042 1.360 8.766
77 1HB ARG 13 1HB ARG 13 0.383 -1.062 6.928
78 2HB ARG 13 2HB ARG 13 1.613 -0.530 8.058
79 1HG ARG 13 1HG ARG 13 -1.105 -0.850 9.244
80 2HG ARG 13 2HG ARG 13 -0.386 -2.338 8.660
81 1HD ARG 13 1HD ARG 13 1.675 -0.893 10.061
82 2HD ARG 13 2HD ARG 13 0.243 -0.862 11.071
83 HE ARG 13 HE ARG 13 0.357 -3.500 10.244
84 1HH1 ARG 13 1HH1 ARG 13 2.667 -1.334 11.779
85 2HH1 ARG 13 2HH1 ARG 13 3.500 -2.605 12.611
86 1HH2 ARG 13 1HH2 ARG 13 1.456 -5.177 11.341
87 2HH2 ARG 13 2HH2 ARG 13 2.806 -4.805 12.360
88 H THR 14 H THR 14 1.035 3.240 8.055
89 HA THR 14 HA THR 14 1.484 3.807 5.332
90 HB THR 14 HB THR 14 2.720 5.759 6.317
91 HG1 THR 14 HG1 THR 14 2.711 5.605 8.788
92 1HG2 THR 14 1HG2 THR 14 0.025 5.297 6.631
93 2HG2 THR 14 2HG2 THR 14 0.534 5.408 8.333
94 3HG2 THR 14 3HG2 THR 14 0.839 6.766 7.224
95 H ALA 15 H ALA 15 4.112 4.829 5.250
96 HA ALA 15 HA ALA 15 5.505 2.320 4.833
97 1HB ALA 15 1HB ALA 15 5.476 5.000 3.684
98 2HB ALA 15 2HB ALA 15 7.134 4.481 4.069
99 3HB ALA 15 3HB ALA 15 6.114 3.484 3.005
100 H ASP 16 H ASP 16 4.929 4.019 7.514
101 HA ASP 16 HA ASP 16 7.711 3.930 8.378
102 1HB ASP 16 1HB ASP 16 5.377 5.694 9.046
103 2HB ASP 16 2HB ASP 16 6.439 5.290 10.380
104 H GLY 17 H GLY 17 4.476 2.632 8.649
105 1HA GLY 17 1HA GLY 17 4.051 0.579 9.693
106 2HA GLY 17 2HA GLY 17 5.343 0.877 10.840
107 H ARG 18 H ARG 18 3.761 3.821 10.494
108 HA ARG 18 HA ARG 18 2.501 3.455 13.015
109 1HB ARG 18 1HB ARG 18 2.424 5.906 11.188
110 2HB ARG 18 2HB ARG 18 2.086 5.881 12.907
111 1HG ARG 18 1HG ARG 18 4.396 5.343 13.445
112 2HG ARG 18 2HG ARG 18 4.779 5.017 11.766
113 1HD ARG 18 1HD ARG 18 5.430 7.187 11.576
114 2HD ARG 18 2HD ARG 18 3.745 7.644 11.724
115 HE ARG 18 HE ARG 18 5.795 7.790 13.831
116 1HH1 ARG 18 1HH1 ARG 18 2.351 7.804 13.106
117 2HH1 ARG 18 2HH1 ARG 18 1.914 8.598 14.582
118 1HH2 ARG 18 1HH2 ARG 18 5.219 8.837 15.778
119 2HH2 ARG 18 2HH2 ARG 18 3.556 9.190 16.112
120 H CYS 19 H CYS 19 0.461 2.567 13.148
121 HA CYS 19 HA CYS 19 -1.204 2.172 11.006
122 1HB CYS 19 1HB CYS 19 -1.811 2.345 13.960
123 2HB CYS 19 2HB CYS 19 -2.998 1.868 12.763
124 H LYS 20 H LYS 20 -1.679 3.963 9.695
125 HA LYS 20 HA LYS 20 -2.586 6.395 11.007
126 1HB LYS 20 1HB LYS 20 -1.444 5.678 8.363
127 2HB LYS 20 2HB LYS 20 -2.647 6.951 8.352
128 1HG LYS 20 1HG LYS 20 -0.723 7.243 10.576
129 2HG LYS 20 2HG LYS 20 0.063 7.249 9.010
130 1HD LYS 20 1HD LYS 20 -1.758 8.965 8.288
131 2HD LYS 20 2HD LYS 20 -2.138 9.108 9.993
132 1HE LYS 20 1HE LYS 20 0.769 9.307 9.341
133 2HE LYS 20 2HE LYS 20 -0.217 10.606 8.700
134 1HZ LYS 20 1HZ LYS 20 -0.371 9.754 11.502
135 2HZ LYS 20 2HZ LYS 20 0.642 10.928 10.990
136 3HZ LYS 20 3HZ LYS 20 -0.973 11.121 10.842
137 HA PRO 21 HA PRO 21 -6.751 5.753 10.070
138 1HB PRO 21 1HB PRO 21 -7.680 8.221 9.355
139 2HB PRO 21 2HB PRO 21 -7.399 7.749 11.018
140 1HG PRO 21 1HG PRO 21 -5.780 9.527 9.298
141 2HG PRO 21 2HG PRO 21 -5.766 9.377 11.044
142 1HD PRO 21 1HD PRO 21 -3.830 8.313 9.215
143 2HD PRO 21 2HD PRO 21 -3.880 8.066 10.949
144 H THR 22 H THR 22 -8.280 5.111 8.563
145 HA THR 22 HA THR 22 -7.226 5.358 5.834
146 HB THR 22 HB THR 22 -9.347 3.445 6.927
147 HG1 THR 22 HG1 THR 22 -6.469 3.089 6.513
148 1HG2 THR 22 1HG2 THR 22 -7.400 3.341 4.563
149 2HG2 THR 22 2HG2 THR 22 -8.450 1.997 5.073
150 3HG2 THR 22 3HG2 THR 22 -9.169 3.500 4.449
151 H PHE 23 H PHE 23 -9.083 7.195 7.714
152 HA PHE 23 HA PHE 23 -11.564 7.443 6.818
153 1HB PHE 23 1HB PHE 23 -9.491 9.715 6.894
154 2HB PHE 23 2HB PHE 23 -11.212 9.899 7.173
155 HD1 PHE 23 HD1 PHE 23 -11.383 7.280 8.886
156 HD2 PHE 23 HD2 PHE 23 -8.874 10.700 9.003
157 HE1 PHE 23 HE1 PHE 23 -11.022 6.931 11.345
158 HE2 PHE 23 HE2 PHE 23 -8.512 10.351 11.462
159 HZ PHE 23 HZ PHE 23 -9.590 8.470 12.604
Start of MODEL 6
1 H GLU 1 H GLU 1 -7.366 -14.922 14.821
2 HA GLU 1 HA GLU 1 -6.947 -12.652 15.432
3 1HB GLU 1 1HB GLU 1 -5.051 -14.840 15.738
4 2HB GLU 1 2HB GLU 1 -4.193 -13.313 15.722
5 1HG GLU 1 1HG GLU 1 -5.948 -12.468 17.428
6 2HG GLU 1 2HG GLU 1 -6.469 -14.135 17.575
7 H ASN 2 H ASN 2 -7.171 -11.105 13.751
8 HA ASN 2 HA ASN 2 -5.349 -10.949 11.648
9 1HB ASN 2 1HB ASN 2 -7.224 -8.840 12.842
10 2HB ASN 2 2HB ASN 2 -6.384 -8.643 11.318
11 1HD2 ASN 2 2HD2 ASN 2 -9.227 -9.450 12.667
12 2HD2 ASN 2 1HD2 ASN 2 -9.921 -10.473 11.454
13 H PHE 3 H PHE 3 -3.594 -9.381 11.335
14 HA PHE 3 HA PHE 3 -2.933 -7.492 13.323
15 1HB PHE 3 1HB PHE 3 -2.320 -9.858 14.293
16 2HB PHE 3 2HB PHE 3 -1.106 -9.943 13.031
17 HD1 PHE 3 HD1 PHE 3 -2.179 -7.259 15.407
18 HD2 PHE 3 HD2 PHE 3 1.001 -9.619 13.883
19 HE1 PHE 3 HE1 PHE 3 -0.562 -6.029 16.880
20 HE2 PHE 3 HE2 PHE 3 2.619 -8.390 15.357
21 HZ PHE 3 HZ PHE 3 1.819 -6.609 16.838
22 H ASN 4 H ASN 4 -2.737 -6.083 11.536
23 HA ASN 4 HA ASN 4 -0.697 -6.844 9.612
24 1HB ASN 4 1HB ASN 4 -1.689 -4.728 8.393
25 2HB ASN 4 2HB ASN 4 -2.635 -6.203 8.400
26 1HD2 ASN 4 2HD2 ASN 4 -2.818 -2.994 8.769
27 2HD2 ASN 4 1HD2 ASN 4 -4.183 -2.828 9.822
28 H GLY 5 H GLY 5 0.584 -6.222 11.863
29 1HA GLY 5 1HA GLY 5 2.432 -4.705 12.054
30 2HA GLY 5 2HA GLY 5 1.380 -3.393 11.563
31 H GLY 6 H GLY 6 -0.957 -4.062 13.138
32 1HA GLY 6 1HA GLY 6 -1.278 -4.603 15.540
33 2HA GLY 6 2HA GLY 6 0.112 -3.582 15.856
34 H CYS 7 H CYS 7 -2.876 -3.314 13.785
35 HA CYS 7 HA CYS 7 -3.121 -0.570 14.722
36 1HB CYS 7 1HB CYS 7 -4.472 -2.028 12.442
37 2HB CYS 7 2HB CYS 7 -4.800 -0.368 12.893
38 H LEU 8 H LEU 8 -5.730 0.002 14.771
39 HA LEU 8 HA LEU 8 -6.738 -1.745 16.852
40 1HB LEU 8 1HB LEU 8 -6.710 0.581 17.345
41 2HB LEU 8 2HB LEU 8 -7.517 0.985 15.843
42 HG LEU 8 HG LEU 8 -9.583 -0.060 16.621
43 1HD1 LEU 8 1HD1 LEU 8 -8.419 -1.805 18.028
44 2HD1 LEU 8 2HD1 LEU 8 -8.238 -0.556 19.283
45 3HD1 LEU 8 3HD1 LEU 8 -9.862 -1.056 18.754
46 1HD2 LEU 8 1HD2 LEU 8 -8.514 2.329 17.490
47 2HD2 LEU 8 2HD2 LEU 8 -10.210 1.817 17.652
48 3HD2 LEU 8 3HD2 LEU 8 -9.072 1.567 18.998
49 H ALA 9 H ALA 9 -7.909 -0.286 13.736
50 HA ALA 9 HA ALA 9 -8.833 -2.475 12.527
51 1HB ALA 9 1HB ALA 9 -10.501 -1.861 14.891
52 2HB ALA 9 2HB ALA 9 -11.417 -2.065 13.379
53 3HB ALA 9 3HB ALA 9 -10.351 -3.368 13.957
54 H GLY 10 H GLY 10 -8.677 -1.401 10.605
55 1HA GLY 10 1HA GLY 10 -10.045 -0.199 9.022
56 2HA GLY 10 2HA GLY 10 -10.418 0.966 10.276
57 H TYR 11 H TYR 11 -7.687 1.081 11.416
58 HA TYR 11 HA TYR 11 -6.655 3.131 9.823
59 1HB TYR 11 1HB TYR 11 -5.508 1.258 11.985
60 2HB TYR 11 2HB TYR 11 -4.650 2.682 11.428
61 HD1 TYR 11 HD1 TYR 11 -5.965 4.961 11.613
62 HD2 TYR 11 HD2 TYR 11 -6.942 1.428 13.820
63 HE1 TYR 11 HE1 TYR 11 -7.194 6.369 13.336
64 HE2 TYR 11 HE2 TYR 11 -8.168 2.849 15.536
65 HH TYR 11 HH TYR 11 -9.300 5.635 15.088
66 H MET 12 H MET 12 -4.557 3.241 8.713
67 HA MET 12 HA MET 12 -3.936 0.663 7.496
68 1HB MET 12 1HB MET 12 -2.968 2.291 5.647
69 2HB MET 12 2HB MET 12 -4.705 2.082 5.743
70 1HG MET 12 1HG MET 12 -5.061 4.210 6.650
71 2HG MET 12 2HG MET 12 -3.496 4.258 7.438
72 1HE MET 12 1HE MET 12 -3.785 6.557 6.775
73 2HE MET 12 2HE MET 12 -2.104 6.624 6.196
74 3HE MET 12 3HE MET 12 -3.421 7.264 5.183
75 H ARG 13 H ARG 13 -1.621 0.336 6.830
76 HA ARG 13 HA ARG 13 0.068 1.527 8.856
77 1HB ARG 13 1HB ARG 13 1.608 -0.364 8.391
78 2HB ARG 13 2HB ARG 13 -0.004 -0.959 8.733
79 1HG ARG 13 1HG ARG 13 0.131 -2.105 6.775
80 2HG ARG 13 2HG ARG 13 -0.075 -0.565 5.965
81 1HD ARG 13 1HD ARG 13 2.072 -0.580 5.206
82 2HD ARG 13 2HD ARG 13 2.708 -0.894 6.808
83 HE ARG 13 HE ARG 13 1.466 -3.234 5.528
84 1HH1 ARG 13 1HH1 ARG 13 4.439 -1.419 6.026
85 2HH1 ARG 13 2HH1 ARG 13 5.471 -2.761 5.660
86 1HH2 ARG 13 1HH2 ARG 13 2.827 -5.006 5.045
87 2HH2 ARG 13 2HH2 ARG 13 4.548 -4.815 5.099
88 H THR 14 H THR 14 1.091 3.380 8.130
89 HA THR 14 HA THR 14 1.477 4.002 5.434
90 HB THR 14 HB THR 14 2.713 5.895 6.355
91 HG1 THR 14 HG1 THR 14 2.869 4.012 8.596
92 1HG2 THR 14 1HG2 THR 14 0.221 5.046 7.539
93 2HG2 THR 14 2HG2 THR 14 1.247 5.695 8.840
94 3HG2 THR 14 3HG2 THR 14 0.864 6.702 7.424
95 H ALA 15 H ALA 15 4.301 4.896 5.608
96 HA ALA 15 HA ALA 15 5.445 2.347 4.779
97 1HB ALA 15 1HB ALA 15 5.413 4.506 3.363
98 2HB ALA 15 2HB ALA 15 6.662 5.108 4.480
99 3HB ALA 15 3HB ALA 15 6.966 3.647 3.509
100 H ASP 16 H ASP 16 5.068 3.916 7.634
101 HA ASP 16 HA ASP 16 7.783 3.257 8.469
102 1HB ASP 16 1HB ASP 16 6.145 5.608 8.900
103 2HB ASP 16 2HB ASP 16 6.420 4.840 10.451
104 H GLY 17 H GLY 17 4.492 2.381 8.502
105 1HA GLY 17 1HA GLY 17 3.706 0.446 9.539
106 2HA GLY 17 2HA GLY 17 4.901 0.621 10.810
107 H ARG 18 H ARG 18 3.915 3.731 10.482
108 HA ARG 18 HA ARG 18 2.476 3.710 12.830
109 1HB ARG 18 1HB ARG 18 2.385 5.862 10.658
110 2HB ARG 18 2HB ARG 18 2.061 6.097 12.364
111 1HG ARG 18 1HG ARG 18 4.556 4.990 12.532
112 2HG ARG 18 2HG ARG 18 4.685 5.749 10.957
113 1HD ARG 18 1HD ARG 18 3.404 7.648 12.698
114 2HD ARG 18 2HD ARG 18 4.775 6.996 13.574
115 HE ARG 18 HE ARG 18 6.187 8.154 12.125
116 1HH1 ARG 18 1HH1 ARG 18 3.078 7.706 10.539
117 2HH1 ARG 18 2HH1 ARG 18 3.509 8.644 9.148
118 1HH2 ARG 18 1HH2 ARG 18 6.756 9.391 10.290
119 2HH2 ARG 18 2HH2 ARG 18 5.614 9.609 9.005
120 H CYS 19 H CYS 19 0.446 2.832 13.115
121 HA CYS 19 HA CYS 19 -1.272 2.313 10.973
122 1HB CYS 19 1HB CYS 19 -1.767 2.377 13.954
123 2HB CYS 19 2HB CYS 19 -2.947 1.831 12.779
124 H LYS 20 H LYS 20 -1.791 4.185 9.769
125 HA LYS 20 HA LYS 20 -2.841 6.464 11.252
126 1HB LYS 20 1HB LYS 20 -1.349 6.097 8.800
127 2HB LYS 20 2HB LYS 20 -2.817 6.998 8.480
128 1HG LYS 20 1HG LYS 20 -2.141 8.816 9.721
129 2HG LYS 20 2HG LYS 20 -1.396 7.828 10.962
130 1HD LYS 20 1HD LYS 20 0.577 7.435 9.555
131 2HD LYS 20 2HD LYS 20 -0.183 8.226 8.188
132 1HE LYS 20 1HE LYS 20 -0.385 10.229 10.048
133 2HE LYS 20 2HE LYS 20 1.064 9.433 10.629
134 1HZ LYS 20 1HZ LYS 20 0.673 10.272 7.841
135 2HZ LYS 20 2HZ LYS 20 1.480 11.148 8.958
136 3HZ LYS 20 3HZ LYS 20 2.049 9.689 8.498
137 HA PRO 21 HA PRO 21 -6.926 5.769 10.027
138 1HB PRO 21 1HB PRO 21 -7.884 8.185 9.185
139 2HB PRO 21 2HB PRO 21 -7.684 7.770 10.876
140 1HG PRO 21 1HG PRO 21 -6.022 9.546 9.194
141 2HG PRO 21 2HG PRO 21 -6.104 9.449 10.942
142 1HD PRO 21 1HD PRO 21 -4.037 8.390 9.259
143 2HD PRO 21 2HD PRO 21 -4.178 8.194 10.995
144 H THR 22 H THR 22 -8.358 5.052 8.455
145 HA THR 22 HA THR 22 -7.220 5.381 5.758
146 HB THR 22 HB THR 22 -9.009 3.132 6.802
147 HG1 THR 22 HG1 THR 22 -6.791 3.599 7.869
148 1HG2 THR 22 1HG2 THR 22 -8.424 3.619 4.223
149 2HG2 THR 22 2HG2 THR 22 -6.864 2.895 4.681
150 3HG2 THR 22 3HG2 THR 22 -8.367 1.961 4.867
151 H PHE 23 H PHE 23 -9.394 6.866 7.610
152 HA PHE 23 HA PHE 23 -11.537 6.773 5.628
153 1HB PHE 23 1HB PHE 23 -12.706 8.095 7.505
154 2HB PHE 23 2HB PHE 23 -12.210 6.480 7.973
155 HD1 PHE 23 HD1 PHE 23 -10.856 9.962 7.970
156 HD2 PHE 23 HD2 PHE 23 -11.103 6.233 9.979
157 HE1 PHE 23 HE1 PHE 23 -9.565 10.917 9.900
158 HE2 PHE 23 HE2 PHE 23 -9.812 7.187 11.909
159 HZ PHE 23 HZ PHE 23 -9.058 9.517 11.846
Start of MODEL 7
1 H GLU 1 H GLU 1 -10.744 -13.755 15.882
2 HA GLU 1 HA GLU 1 -9.257 -11.887 15.931
3 1HB GLU 1 1HB GLU 1 -9.004 -13.974 17.485
4 2HB GLU 1 2HB GLU 1 -7.588 -14.352 16.524
5 1HG GLU 1 1HG GLU 1 -6.350 -12.678 17.470
6 2HG GLU 1 2HG GLU 1 -7.655 -11.515 17.343
7 H ASN 2 H ASN 2 -8.419 -10.748 14.215
8 HA ASN 2 HA ASN 2 -6.259 -12.081 12.788
9 1HB ASN 2 1HB ASN 2 -8.764 -11.142 11.703
10 2HB ASN 2 2HB ASN 2 -7.516 -10.059 11.118
11 1HD2 ASN 2 2HD2 ASN 2 -6.223 -10.667 9.524
12 2HD2 ASN 2 1HD2 ASN 2 -6.139 -12.245 8.818
13 H PHE 3 H PHE 3 -4.806 -10.324 11.657
14 HA PHE 3 HA PHE 3 -4.950 -7.757 13.036
15 1HB PHE 3 1HB PHE 3 -3.046 -9.973 13.416
16 2HB PHE 3 2HB PHE 3 -2.196 -8.575 12.790
17 HD1 PHE 3 HD1 PHE 3 -3.109 -6.281 14.032
18 HD2 PHE 3 HD2 PHE 3 -2.964 -10.181 15.699
19 HE1 PHE 3 HE1 PHE 3 -3.034 -5.293 16.339
20 HE2 PHE 3 HE2 PHE 3 -2.889 -9.192 18.005
21 HZ PHE 3 HZ PHE 3 -2.925 -6.760 18.297
22 H ASN 4 H ASN 4 -3.061 -6.280 12.068
23 HA ASN 4 HA ASN 4 -2.552 -6.952 9.321
24 1HB ASN 4 1HB ASN 4 -4.729 -5.783 9.173
25 2HB ASN 4 2HB ASN 4 -4.133 -4.471 10.171
26 1HD2 ASN 4 2HD2 ASN 4 -3.541 -2.732 9.145
27 2HD2 ASN 4 1HD2 ASN 4 -2.928 -2.615 7.530
28 H GLY 5 H GLY 5 -0.677 -6.868 11.346
29 1HA GLY 5 1HA GLY 5 1.475 -5.894 11.236
30 2HA GLY 5 2HA GLY 5 0.761 -4.355 10.802
31 H GLY 6 H GLY 6 -1.416 -4.397 12.780
32 1HA GLY 6 1HA GLY 6 -1.283 -4.817 15.280
33 2HA GLY 6 2HA GLY 6 0.204 -3.892 15.197
34 H CYS 7 H CYS 7 -3.149 -3.584 13.801
35 HA CYS 7 HA CYS 7 -3.067 -0.790 14.677
36 1HB CYS 7 1HB CYS 7 -4.334 -2.107 12.289
37 2HB CYS 7 2HB CYS 7 -4.952 -0.586 12.904
38 H LEU 8 H LEU 8 -5.658 -0.067 14.781
39 HA LEU 8 HA LEU 8 -6.703 -1.782 16.864
40 1HB LEU 8 1HB LEU 8 -6.584 0.544 17.347
41 2HB LEU 8 2HB LEU 8 -7.404 0.971 15.859
42 HG LEU 8 HG LEU 8 -9.497 0.085 16.666
43 1HD1 LEU 8 1HD1 LEU 8 -8.495 -1.843 17.910
44 2HD1 LEU 8 2HD1 LEU 8 -8.106 -0.716 19.232
45 3HD1 LEU 8 3HD1 LEU 8 -9.802 -0.999 18.773
46 1HD2 LEU 8 1HD2 LEU 8 -8.373 2.362 17.541
47 2HD2 LEU 8 2HD2 LEU 8 -10.012 1.839 17.996
48 3HD2 LEU 8 3HD2 LEU 8 -8.647 1.551 19.101
49 H ALA 9 H ALA 9 -7.884 -0.286 13.769
50 HA ALA 9 HA ALA 9 -8.902 -2.440 12.575
51 1HB ALA 9 1HB ALA 9 -10.469 -1.822 14.991
52 2HB ALA 9 2HB ALA 9 -11.456 -1.909 13.512
53 3HB ALA 9 3HB ALA 9 -10.446 -3.294 13.990
54 H GLY 10 H GLY 10 -8.579 -1.244 10.718
55 1HA GLY 10 1HA GLY 10 -10.007 -0.030 9.142
56 2HA GLY 10 2HA GLY 10 -10.304 1.142 10.410
57 H TYR 11 H TYR 11 -7.593 1.214 11.515
58 HA TYR 11 HA TYR 11 -6.495 3.206 9.924
59 1HB TYR 11 1HB TYR 11 -5.384 1.242 12.021
60 2HB TYR 11 2HB TYR 11 -4.460 2.621 11.457
61 HD1 TYR 11 HD1 TYR 11 -5.851 4.949 11.592
62 HD2 TYR 11 HD2 TYR 11 -6.540 1.489 14.013
63 HE1 TYR 11 HE1 TYR 11 -6.949 6.401 13.366
64 HE2 TYR 11 HE2 TYR 11 -7.635 2.954 15.780
65 HH TYR 11 HH TYR 11 -7.669 5.185 16.497
66 H MET 12 H MET 12 -4.450 3.262 8.735
67 HA MET 12 HA MET 12 -3.986 0.697 7.427
68 1HB MET 12 1HB MET 12 -2.962 2.315 5.619
69 2HB MET 12 2HB MET 12 -4.707 2.261 5.767
70 1HG MET 12 1HG MET 12 -4.834 4.368 6.790
71 2HG MET 12 2HG MET 12 -3.232 4.249 7.491
72 1HE MET 12 1HE MET 12 -3.809 6.743 6.634
73 2HE MET 12 2HE MET 12 -2.037 6.613 6.515
74 3HE MET 12 3HE MET 12 -2.968 7.330 5.179
75 H ARG 13 H ARG 13 -1.682 0.342 6.620
76 HA ARG 13 HA ARG 13 0.086 1.176 8.742
77 1HB ARG 13 1HB ARG 13 -0.236 -1.215 7.115
78 2HB ARG 13 2HB ARG 13 1.402 -0.621 6.926
79 1HG ARG 13 1HG ARG 13 0.936 -0.366 9.686
80 2HG ARG 13 2HG ARG 13 0.122 -1.863 9.277
81 1HD ARG 13 1HD ARG 13 2.179 -2.758 8.246
82 2HD ARG 13 2HD ARG 13 3.004 -1.230 8.478
83 HE ARG 13 HE ARG 13 1.960 -2.259 10.988
84 1HH1 ARG 13 1HH1 ARG 13 4.613 -2.575 8.698
85 2HH1 ARG 13 2HH1 ARG 13 5.729 -3.178 9.878
86 1HH2 ARG 13 1HH2 ARG 13 3.432 -3.054 12.545
87 2HH2 ARG 13 2HH2 ARG 13 5.052 -3.453 12.081
88 H THR 14 H THR 14 1.137 3.105 8.306
89 HA THR 14 HA THR 14 1.544 4.077 5.693
90 HB THR 14 HB THR 14 3.109 5.667 7.086
91 HG1 THR 14 HG1 THR 14 3.421 4.787 9.091
92 1HG2 THR 14 1HG2 THR 14 0.145 5.215 7.592
93 2HG2 THR 14 2HG2 THR 14 1.032 6.436 8.536
94 3HG2 THR 14 3HG2 THR 14 0.937 6.579 6.764
95 H ALA 15 H ALA 15 4.162 5.003 5.588
96 HA ALA 15 HA ALA 15 5.450 2.595 4.695
97 1HB ALA 15 1HB ALA 15 5.986 5.566 4.542
98 2HB ALA 15 2HB ALA 15 7.249 4.393 4.095
99 3HB ALA 15 3HB ALA 15 5.697 4.406 3.223
100 H ASP 16 H ASP 16 5.052 3.960 7.697
101 HA ASP 16 HA ASP 16 7.719 3.086 8.494
102 1HB ASP 16 1HB ASP 16 6.268 5.548 9.038
103 2HB ASP 16 2HB ASP 16 6.538 4.701 10.548
104 H GLY 17 H GLY 17 4.453 2.337 8.403
105 1HA GLY 17 1HA GLY 17 3.523 0.460 9.404
106 2HA GLY 17 2HA GLY 17 4.674 0.568 10.722
107 H ARG 18 H ARG 18 3.991 3.696 10.597
108 HA ARG 18 HA ARG 18 2.475 3.771 12.821
109 1HB ARG 18 1HB ARG 18 2.496 5.831 10.556
110 2HB ARG 18 2HB ARG 18 1.994 6.157 12.203
111 1HG ARG 18 1HG ARG 18 4.323 5.395 12.961
112 2HG ARG 18 2HG ARG 18 4.784 5.342 11.271
113 1HD ARG 18 1HD ARG 18 4.627 7.685 11.008
114 2HD ARG 18 2HD ARG 18 3.503 7.867 12.340
115 HE ARG 18 HE ARG 18 5.717 6.959 13.651
116 1HH1 ARG 18 1HH1 ARG 18 5.326 9.483 11.231
117 2HH1 ARG 18 2HH1 ARG 18 6.653 10.429 11.818
118 1HH2 ARG 18 1HH2 ARG 18 7.468 8.206 14.425
119 2HH2 ARG 18 2HH2 ARG 18 7.880 9.698 13.647
120 H CYS 19 H CYS 19 0.429 2.961 13.170
121 HA CYS 19 HA CYS 19 -1.316 2.359 11.077
122 1HB CYS 19 1HB CYS 19 -1.743 2.585 14.059
123 2HB CYS 19 2HB CYS 19 -2.994 2.062 12.949
124 H LYS 20 H LYS 20 -1.797 4.170 9.766
125 HA LYS 20 HA LYS 20 -2.804 6.549 11.116
126 1HB LYS 20 1HB LYS 20 -1.360 5.998 8.654
127 2HB LYS 20 2HB LYS 20 -2.789 6.962 8.340
128 1HG LYS 20 1HG LYS 20 -1.975 8.344 10.467
129 2HG LYS 20 2HG LYS 20 -0.424 7.607 10.117
130 1HD LYS 20 1HD LYS 20 -0.493 8.503 7.798
131 2HD LYS 20 2HD LYS 20 -2.079 9.189 8.093
132 1HE LYS 20 1HE LYS 20 -1.240 10.830 9.592
133 2HE LYS 20 2HE LYS 20 0.224 9.927 9.922
134 1HZ LYS 20 1HZ LYS 20 0.925 10.359 7.661
135 2HZ LYS 20 2HZ LYS 20 -0.437 11.208 7.361
136 3HZ LYS 20 3HZ LYS 20 0.645 11.759 8.453
137 HA PRO 21 HA PRO 21 -6.906 5.844 9.956
138 1HB PRO 21 1HB PRO 21 -7.837 8.236 9.018
139 2HB PRO 21 2HB PRO 21 -7.633 7.890 10.723
140 1HG PRO 21 1HG PRO 21 -5.957 9.571 8.960
141 2HG PRO 21 2HG PRO 21 -6.029 9.547 10.711
142 1HD PRO 21 1HD PRO 21 -3.986 8.392 9.063
143 2HD PRO 21 2HD PRO 21 -4.121 8.270 10.806
144 H THR 22 H THR 22 -8.291 4.995 8.436
145 HA THR 22 HA THR 22 -7.238 5.308 5.702
146 HB THR 22 HB THR 22 -8.833 2.956 6.823
147 HG1 THR 22 HG1 THR 22 -6.770 2.141 7.413
148 1HG2 THR 22 1HG2 THR 22 -6.825 3.256 4.526
149 2HG2 THR 22 2HG2 THR 22 -7.600 1.732 5.023
150 3HG2 THR 22 3HG2 THR 22 -8.583 3.048 4.336
151 H PHE 23 H PHE 23 -9.470 6.663 7.589
152 HA PHE 23 HA PHE 23 -11.633 6.379 5.641
153 1HB PHE 23 1HB PHE 23 -12.877 7.602 7.557
154 2HB PHE 23 2HB PHE 23 -12.289 6.003 7.968
155 HD1 PHE 23 HD1 PHE 23 -11.069 9.538 8.039
156 HD2 PHE 23 HD2 PHE 23 -11.214 5.772 9.988
157 HE1 PHE 23 HE1 PHE 23 -9.818 10.499 9.991
158 HE2 PHE 23 HE2 PHE 23 -9.963 6.733 11.941
159 HZ PHE 23 HZ PHE 23 -9.280 9.086 11.918
Start of MODEL 8
1 H GLU 1 H GLU 1 1.354 -12.582 11.996
2 HA GLU 1 HA GLU 1 1.975 -11.327 10.061
3 1HB GLU 1 1HB GLU 1 1.434 -14.289 9.788
4 2HB GLU 1 2HB GLU 1 2.077 -13.410 8.416
5 1HG GLU 1 1HG GLU 1 3.952 -12.559 9.877
6 2HG GLU 1 2HG GLU 1 3.325 -13.518 11.203
7 H ASN 2 H ASN 2 -0.086 -9.933 9.879
8 HA ASN 2 HA ASN 2 -1.156 -10.424 7.284
9 1HB ASN 2 1HB ASN 2 -2.657 -11.513 9.283
10 2HB ASN 2 2HB ASN 2 -3.267 -9.872 9.368
11 1HD2 ASN 2 2HD2 ASN 2 -5.034 -11.702 8.737
12 2HD2 ASN 2 1HD2 ASN 2 -5.472 -11.685 7.061
13 H PHE 3 H PHE 3 -2.767 -8.446 6.774
14 HA PHE 3 HA PHE 3 -1.433 -6.081 7.779
15 1HB PHE 3 1HB PHE 3 -2.444 -6.977 5.323
16 2HB PHE 3 2HB PHE 3 -3.748 -5.941 5.868
17 HD1 PHE 3 HD1 PHE 3 -2.751 -3.611 6.931
18 HD2 PHE 3 HD2 PHE 3 -0.940 -5.975 3.907
19 HE1 PHE 3 HE1 PHE 3 -1.496 -1.598 6.109
20 HE2 PHE 3 HE2 PHE 3 0.315 -3.963 3.086
21 HZ PHE 3 HZ PHE 3 0.022 -1.799 4.196
22 H ASN 4 H ASN 4 -2.831 -7.176 9.875
23 HA ASN 4 HA ASN 4 -4.469 -5.095 10.608
24 1HB ASN 4 1HB ASN 4 -5.889 -6.766 8.903
25 2HB ASN 4 2HB ASN 4 -6.273 -7.476 10.458
26 1HD2 ASN 4 2HD2 ASN 4 -6.710 -5.751 12.220
27 2HD2 ASN 4 1HD2 ASN 4 -7.827 -4.498 11.796
28 H GLY 5 H GLY 5 -2.276 -6.686 11.618
29 1HA GLY 5 1HA GLY 5 -3.557 -8.110 13.876
30 2HA GLY 5 2HA GLY 5 -2.052 -8.610 13.129
31 H GLY 6 H GLY 6 -3.124 -5.234 13.844
32 1HA GLY 6 1HA GLY 6 -1.507 -5.008 16.198
33 2HA GLY 6 2HA GLY 6 -0.736 -4.299 14.794
34 H CYS 7 H CYS 7 -2.726 -3.142 13.317
35 HA CYS 7 HA CYS 7 -3.206 -0.787 14.613
36 1HB CYS 7 1HB CYS 7 -4.611 -2.082 12.277
37 2HB CYS 7 2HB CYS 7 -5.011 -0.470 12.837
38 H LEU 8 H LEU 8 -5.686 0.071 14.840
39 HA LEU 8 HA LEU 8 -6.802 -1.576 16.913
40 1HB LEU 8 1HB LEU 8 -6.641 0.762 17.307
41 2HB LEU 8 2HB LEU 8 -7.455 1.149 15.804
42 HG LEU 8 HG LEU 8 -9.550 0.191 16.681
43 1HD1 LEU 8 1HD1 LEU 8 -7.787 -0.889 18.694
44 2HD1 LEU 8 2HD1 LEU 8 -9.096 0.052 19.449
45 3HD1 LEU 8 3HD1 LEU 8 -9.487 -1.283 18.338
46 1HD2 LEU 8 1HD2 LEU 8 -8.173 2.405 18.182
47 2HD2 LEU 8 2HD2 LEU 8 -9.455 2.497 16.951
48 3HD2 LEU 8 3HD2 LEU 8 -9.836 1.915 18.589
49 H ALA 9 H ALA 9 -7.972 -0.177 13.769
50 HA ALA 9 HA ALA 9 -9.033 -2.354 12.658
51 1HB ALA 9 1HB ALA 9 -10.607 -1.585 15.043
52 2HB ALA 9 2HB ALA 9 -11.571 -1.803 13.562
53 3HB ALA 9 3HB ALA 9 -10.547 -3.130 14.160
54 H GLY 10 H GLY 10 -8.816 -1.306 10.719
55 1HA GLY 10 1HA GLY 10 -10.175 -0.108 9.117
56 2HA GLY 10 2HA GLY 10 -10.492 1.102 10.345
57 H TYR 11 H TYR 11 -7.737 1.135 11.448
58 HA TYR 11 HA TYR 11 -6.656 3.110 9.787
59 1HB TYR 11 1HB TYR 11 -5.542 1.261 11.986
60 2HB TYR 11 2HB TYR 11 -4.656 2.650 11.387
61 HD1 TYR 11 HD1 TYR 11 -5.877 4.967 11.555
62 HD2 TYR 11 HD2 TYR 11 -6.987 1.505 13.809
63 HE1 TYR 11 HE1 TYR 11 -7.054 6.444 13.257
64 HE2 TYR 11 HE2 TYR 11 -8.160 2.993 15.504
65 HH TYR 11 HH TYR 11 -8.987 5.046 15.825
66 H MET 12 H MET 12 -4.535 3.109 8.689
67 HA MET 12 HA MET 12 -4.025 0.478 7.533
68 1HB MET 12 1HB MET 12 -3.160 1.836 5.547
69 2HB MET 12 2HB MET 12 -4.873 2.047 5.852
70 1HG MET 12 1HG MET 12 -4.433 4.165 7.065
71 2HG MET 12 2HG MET 12 -2.705 3.939 6.883
72 1HE MET 12 1HE MET 12 -1.941 5.902 5.584
73 2HE MET 12 2HE MET 12 -2.882 6.701 4.301
74 3HE MET 12 3HE MET 12 -3.528 6.613 5.958
75 H ARG 13 H ARG 13 -1.672 0.287 6.631
76 HA ARG 13 HA ARG 13 0.049 1.320 8.725
77 1HB ARG 13 1HB ARG 13 0.431 -1.018 6.787
78 2HB ARG 13 2HB ARG 13 1.616 -0.532 7.983
79 1HG ARG 13 1HG ARG 13 -0.948 -0.800 9.302
80 2HG ARG 13 2HG ARG 13 -0.670 -2.241 8.343
81 1HD ARG 13 1HD ARG 13 1.817 -1.939 9.466
82 2HD ARG 13 2HD ARG 13 0.831 -1.228 10.728
83 HE ARG 13 HE ARG 13 -0.419 -3.662 9.933
84 1HH1 ARG 13 1HH1 ARG 13 2.527 -2.582 11.525
85 2HH1 ARG 13 2HH1 ARG 13 2.706 -4.031 12.458
86 1HH2 ARG 13 1HH2 ARG 13 -0.184 -5.573 11.163
87 2HH2 ARG 13 2HH2 ARG 13 1.153 -5.743 12.250
88 H THR 14 H THR 14 1.076 3.201 8.085
89 HA THR 14 HA THR 14 1.450 3.878 5.367
90 HB THR 14 HB THR 14 2.699 5.800 6.401
91 HG1 THR 14 HG1 THR 14 3.478 5.432 8.453
92 1HG2 THR 14 1HG2 THR 14 -0.018 5.022 7.073
93 2HG2 THR 14 2HG2 THR 14 0.735 5.776 8.498
94 3HG2 THR 14 3HG2 THR 14 0.660 6.664 6.958
95 H ALA 15 H ALA 15 4.102 4.932 5.361
96 HA ALA 15 HA ALA 15 5.490 2.442 4.798
97 1HB ALA 15 1HB ALA 15 5.239 4.780 3.410
98 2HB ALA 15 2HB ALA 15 6.780 5.063 4.253
99 3HB ALA 15 3HB ALA 15 6.589 3.639 3.202
100 H ASP 16 H ASP 16 4.941 4.066 7.541
101 HA ASP 16 HA ASP 16 7.730 3.931 8.375
102 1HB ASP 16 1HB ASP 16 5.466 5.753 9.014
103 2HB ASP 16 2HB ASP 16 6.361 5.221 10.424
104 H GLY 17 H GLY 17 4.489 2.650 8.641
105 1HA GLY 17 1HA GLY 17 4.057 0.571 9.629
106 2HA GLY 17 2HA GLY 17 5.361 0.827 10.771
107 H ARG 18 H ARG 18 3.799 3.791 10.525
108 HA ARG 18 HA ARG 18 2.557 3.360 13.046
109 1HB ARG 18 1HB ARG 18 2.501 5.867 11.295
110 2HB ARG 18 2HB ARG 18 2.163 5.794 13.013
111 1HG ARG 18 1HG ARG 18 4.829 4.755 12.048
112 2HG ARG 18 2HG ARG 18 4.587 6.491 12.086
113 1HD ARG 18 1HD ARG 18 4.390 6.561 14.422
114 2HD ARG 18 2HD ARG 18 3.773 4.925 14.531
115 HE ARG 18 HE ARG 18 6.597 5.731 14.450
116 1HH1 ARG 18 1HH1 ARG 18 4.319 3.087 14.002
117 2HH1 ARG 18 2HH1 ARG 18 5.507 1.851 14.250
118 1HH2 ARG 18 1HH2 ARG 18 8.165 4.101 14.777
119 2HH2 ARG 18 2HH2 ARG 18 7.710 2.432 14.694
120 H CYS 19 H CYS 19 0.507 2.494 13.170
121 HA CYS 19 HA CYS 19 -1.178 2.173 11.033
122 1HB CYS 19 1HB CYS 19 -1.770 2.297 13.993
123 2HB CYS 19 2HB CYS 19 -2.967 1.855 12.791
124 H LYS 20 H LYS 20 -1.865 3.879 9.757
125 HA LYS 20 HA LYS 20 -2.701 6.321 11.138
126 1HB LYS 20 1HB LYS 20 -1.261 5.765 8.683
127 2HB LYS 20 2HB LYS 20 -2.675 6.746 8.357
128 1HG LYS 20 1HG LYS 20 -1.969 8.289 10.250
129 2HG LYS 20 2HG LYS 20 -0.499 7.349 10.414
130 1HD LYS 20 1HD LYS 20 -0.719 7.951 7.635
131 2HD LYS 20 2HD LYS 20 -1.136 9.433 8.473
132 1HE LYS 20 1HE LYS 20 0.970 9.582 9.548
133 2HE LYS 20 2HE LYS 20 1.296 7.869 9.376
134 1HZ LYS 20 1HZ LYS 20 1.004 9.483 6.975
135 2HZ LYS 20 2HZ LYS 20 2.404 9.564 7.812
136 3HZ LYS 20 3HZ LYS 20 1.894 8.134 7.210
137 HA PRO 21 HA PRO 21 -6.823 5.734 9.991
138 1HB PRO 21 1HB PRO 21 -7.699 8.179 9.138
139 2HB PRO 21 2HB PRO 21 -7.495 7.771 10.830
140 1HG PRO 21 1HG PRO 21 -5.788 9.468 9.114
141 2HG PRO 21 2HG PRO 21 -5.852 9.389 10.864
142 1HD PRO 21 1HD PRO 21 -3.847 8.238 9.166
143 2HD PRO 21 2HD PRO 21 -3.974 8.062 10.905
144 H THR 22 H THR 22 -8.278 5.028 8.446
145 HA THR 22 HA THR 22 -7.144 5.255 5.740
146 HB THR 22 HB THR 22 -9.107 3.185 6.844
147 HG1 THR 22 HG1 THR 22 -6.186 3.343 6.601
148 1HG2 THR 22 1HG2 THR 22 -8.273 3.669 4.223
149 2HG2 THR 22 2HG2 THR 22 -7.083 2.474 4.793
150 3HG2 THR 22 3HG2 THR 22 -8.821 2.092 4.840
151 H PHE 23 H PHE 23 -9.189 6.958 7.552
152 HA PHE 23 HA PHE 23 -11.663 6.977 6.606
153 1HB PHE 23 1HB PHE 23 -9.809 9.431 6.663
154 2HB PHE 23 2HB PHE 23 -11.539 9.450 6.943
155 HD1 PHE 23 HD1 PHE 23 -11.626 6.965 8.733
156 HD2 PHE 23 HD2 PHE 23 -9.118 10.387 8.718
157 HE1 PHE 23 HE1 PHE 23 -11.232 6.687 11.196
158 HE2 PHE 23 HE2 PHE 23 -8.724 10.110 11.180
159 HZ PHE 23 HZ PHE 23 -9.785 8.263 12.390
Start of MODEL 9
1 H GLU 1 H GLU 1 -7.870 -11.037 25.213
2 HA GLU 1 HA GLU 1 -8.651 -9.149 23.976
3 1HB GLU 1 1HB GLU 1 -5.720 -9.851 23.968
4 2HB GLU 1 2HB GLU 1 -6.223 -8.391 23.139
5 1HG GLU 1 1HG GLU 1 -7.565 -7.889 25.363
6 2HG GLU 1 2HG GLU 1 -6.496 -9.079 26.081
7 H ASN 2 H ASN 2 -8.404 -7.888 21.866
8 HA ASN 2 HA ASN 2 -8.760 -9.779 19.714
9 1HB ASN 2 1HB ASN 2 -10.121 -7.451 20.449
10 2HB ASN 2 2HB ASN 2 -9.107 -6.877 19.140
11 1HD2 ASN 2 2HD2 ASN 2 -11.998 -8.261 19.931
12 2HD2 ASN 2 1HD2 ASN 2 -12.464 -8.948 18.410
13 H PHE 3 H PHE 3 -7.806 -9.058 17.489
14 HA PHE 3 HA PHE 3 -5.638 -7.228 17.510
15 1HB PHE 3 1HB PHE 3 -5.109 -9.787 18.521
16 2HB PHE 3 2HB PHE 3 -4.749 -10.013 16.821
17 HD1 PHE 3 HD1 PHE 3 -4.088 -7.387 19.407
18 HD2 PHE 3 HD2 PHE 3 -2.531 -9.794 16.277
19 HE1 PHE 3 HE1 PHE 3 -1.819 -6.370 19.753
20 HE2 PHE 3 HE2 PHE 3 -0.263 -8.776 16.623
21 HZ PHE 3 HZ PHE 3 0.066 -7.078 18.357
22 H ASN 4 H ASN 4 -4.727 -6.924 15.355
23 HA ASN 4 HA ASN 4 -5.827 -8.539 13.269
24 1HB ASN 4 1HB ASN 4 -7.630 -6.854 13.591
25 2HB ASN 4 2HB ASN 4 -6.464 -5.550 13.490
26 1HD2 ASN 4 2HD2 ASN 4 -6.318 -4.575 11.629
27 2HD2 ASN 4 1HD2 ASN 4 -6.665 -5.231 10.063
28 H GLY 5 H GLY 5 -3.163 -8.177 14.216
29 1HA GLY 5 1HA GLY 5 -1.244 -8.060 12.834
30 2HA GLY 5 2HA GLY 5 -1.955 -6.721 11.956
31 H GLY 6 H GLY 6 -2.951 -5.238 14.287
32 1HA GLY 6 1HA GLY 6 -1.302 -4.732 16.353
33 2HA GLY 6 2HA GLY 6 -0.465 -3.950 15.026
34 H CYS 7 H CYS 7 -2.566 -2.990 13.425
35 HA CYS 7 HA CYS 7 -3.184 -0.624 14.654
36 1HB CYS 7 1HB CYS 7 -4.564 -2.042 12.369
37 2HB CYS 7 2HB CYS 7 -4.932 -0.399 12.855
38 H LEU 8 H LEU 8 -5.728 0.078 14.812
39 HA LEU 8 HA LEU 8 -6.766 -1.598 16.914
40 1HB LEU 8 1HB LEU 8 -6.715 0.746 17.303
41 2HB LEU 8 2HB LEU 8 -7.531 1.091 15.791
42 HG LEU 8 HG LEU 8 -9.584 0.003 16.663
43 1HD1 LEU 8 1HD1 LEU 8 -8.137 -1.384 18.357
44 2HD1 LEU 8 2HD1 LEU 8 -8.428 0.008 19.426
45 3HD1 LEU 8 3HD1 LEU 8 -9.803 -0.906 18.761
46 1HD2 LEU 8 1HD2 LEU 8 -8.385 2.335 18.155
47 2HD2 LEU 8 2HD2 LEU 8 -9.570 2.343 16.827
48 3HD2 LEU 8 3HD2 LEU 8 -10.050 1.776 18.446
49 H ALA 9 H ALA 9 -7.967 -0.270 13.751
50 HA ALA 9 HA ALA 9 -8.925 -2.508 12.658
51 1HB ALA 9 1HB ALA 9 -10.626 -1.683 14.962
52 2HB ALA 9 2HB ALA 9 -11.484 -2.124 13.466
53 3HB ALA 9 3HB ALA 9 -10.382 -3.290 14.237
54 H GLY 10 H GLY 10 -8.689 -1.468 10.712
55 1HA GLY 10 1HA GLY 10 -10.080 -0.349 9.068
56 2HA GLY 10 2HA GLY 10 -10.444 0.873 10.271
57 H TYR 11 H TYR 11 -7.804 1.173 11.430
58 HA TYR 11 HA TYR 11 -6.736 3.102 9.771
59 1HB TYR 11 1HB TYR 11 -5.567 1.261 11.948
60 2HB TYR 11 2HB TYR 11 -4.706 2.667 11.352
61 HD1 TYR 11 HD1 TYR 11 -5.926 4.967 11.560
62 HD2 TYR 11 HD2 TYR 11 -7.045 1.470 13.756
63 HE1 TYR 11 HE1 TYR 11 -7.118 6.416 13.276
64 HE2 TYR 11 HE2 TYR 11 -8.233 2.931 15.464
65 HH TYR 11 HH TYR 11 -8.509 6.418 14.970
66 H MET 12 H MET 12 -4.600 3.178 8.686
67 HA MET 12 HA MET 12 -4.059 0.594 7.443
68 1HB MET 12 1HB MET 12 -3.134 2.061 5.546
69 2HB MET 12 2HB MET 12 -4.860 2.217 5.805
70 1HG MET 12 1HG MET 12 -4.675 4.417 6.384
71 2HG MET 12 2HG MET 12 -3.366 4.095 7.502
72 1HE MET 12 1HE MET 12 -4.164 6.293 4.950
73 2HE MET 12 2HE MET 12 -3.002 6.736 6.223
74 3HE MET 12 3HE MET 12 -2.523 6.825 4.512
75 H ARG 13 H ARG 13 -1.708 0.357 6.632
76 HA ARG 13 HA ARG 13 -0.006 1.376 8.750
77 1HB ARG 13 1HB ARG 13 0.325 -1.017 6.873
78 2HB ARG 13 2HB ARG 13 1.537 -0.525 8.039
79 1HG ARG 13 1HG ARG 13 -1.232 -0.864 9.125
80 2HG ARG 13 2HG ARG 13 -0.450 -2.335 8.580
81 1HD ARG 13 1HD ARG 13 1.612 -1.169 9.993
82 2HD ARG 13 2HD ARG 13 0.231 -0.572 10.893
83 HE ARG 13 HE ARG 13 -0.414 -3.206 10.682
84 1HH1 ARG 13 1HH1 ARG 13 2.615 -1.647 11.564
85 2HH1 ARG 13 2HH1 ARG 13 3.133 -2.946 12.588
86 1HH2 ARG 13 1HH2 ARG 13 0.268 -4.919 12.032
87 2HH2 ARG 13 2HH2 ARG 13 1.789 -4.819 12.855
88 H THR 14 H THR 14 1.073 3.223 8.094
89 HA THR 14 HA THR 14 1.522 3.831 5.368
90 HB THR 14 HB THR 14 2.985 5.656 6.533
91 HG1 THR 14 HG1 THR 14 3.256 4.180 8.442
92 1HG2 THR 14 1HG2 THR 14 0.089 5.258 6.573
93 2HG2 THR 14 2HG2 THR 14 0.614 6.077 8.064
94 3HG2 THR 14 3HG2 THR 14 0.999 6.786 6.478
95 H ALA 15 H ALA 15 4.130 4.785 5.215
96 HA ALA 15 HA ALA 15 5.496 2.269 4.815
97 1HB ALA 15 1HB ALA 15 5.685 5.079 3.844
98 2HB ALA 15 2HB ALA 15 7.220 4.183 3.953
99 3HB ALA 15 3HB ALA 15 5.886 3.546 2.961
100 H ASP 16 H ASP 16 4.949 3.963 7.508
101 HA ASP 16 HA ASP 16 7.729 3.813 8.372
102 1HB ASP 16 1HB ASP 16 5.585 5.758 8.809
103 2HB ASP 16 2HB ASP 16 6.165 5.144 10.345
104 H GLY 17 H GLY 17 4.458 2.597 8.650
105 1HA GLY 17 1HA GLY 17 3.995 0.537 9.673
106 2HA GLY 17 2HA GLY 17 5.294 0.801 10.820
107 H ARG 18 H ARG 18 3.803 3.785 10.524
108 HA ARG 18 HA ARG 18 2.529 3.426 13.034
109 1HB ARG 18 1HB ARG 18 2.480 5.893 11.228
110 2HB ARG 18 2HB ARG 18 2.177 5.857 12.953
111 1HG ARG 18 1HG ARG 18 4.825 4.882 11.821
112 2HG ARG 18 2HG ARG 18 4.550 6.588 12.116
113 1HD ARG 18 1HD ARG 18 4.146 6.193 14.493
114 2HD ARG 18 2HD ARG 18 4.120 4.457 14.260
115 HE ARG 18 HE ARG 18 6.621 5.721 13.385
116 1HH1 ARG 18 1HH1 ARG 18 4.899 4.271 16.089
117 2HH1 ARG 18 2HH1 ARG 18 6.342 3.874 16.961
118 1HH2 ARG 18 1HH2 ARG 18 8.525 5.198 14.535
119 2HH2 ARG 18 2HH2 ARG 18 8.419 4.405 16.071
120 H CYS 19 H CYS 19 0.476 2.574 13.166
121 HA CYS 19 HA CYS 19 -1.206 2.254 11.012
122 1HB CYS 19 1HB CYS 19 -1.824 2.354 13.969
123 2HB CYS 19 2HB CYS 19 -2.982 1.871 12.745
124 H LYS 20 H LYS 20 -1.918 3.969 9.765
125 HA LYS 20 HA LYS 20 -2.757 6.387 11.189
126 1HB LYS 20 1HB LYS 20 -1.233 5.917 8.799
127 2HB LYS 20 2HB LYS 20 -2.694 6.786 8.372
128 1HG LYS 20 1HG LYS 20 -1.256 8.548 8.954
129 2HG LYS 20 2HG LYS 20 -2.128 8.301 10.454
130 1HD LYS 20 1HD LYS 20 -0.277 6.873 11.315
131 2HD LYS 20 2HD LYS 20 0.589 7.062 9.803
132 1HE LYS 20 1HE LYS 20 0.979 9.399 10.180
133 2HE LYS 20 2HE LYS 20 -0.251 9.494 11.424
134 1HZ LYS 20 1HZ LYS 20 1.679 7.567 12.096
135 2HZ LYS 20 2HZ LYS 20 2.405 8.997 11.789
136 3HZ LYS 20 3HZ LYS 20 1.232 8.904 12.921
137 HA PRO 21 HA PRO 21 -6.869 5.805 10.005
138 1HB PRO 21 1HB PRO 21 -7.753 8.265 9.207
139 2HB PRO 21 2HB PRO 21 -7.557 7.817 10.889
140 1HG PRO 21 1HG PRO 21 -5.849 9.564 9.225
141 2HG PRO 21 2HG PRO 21 -5.923 9.443 10.972
142 1HD PRO 21 1HD PRO 21 -3.901 8.344 9.259
143 2HD PRO 21 2HD PRO 21 -4.038 8.125 10.991
144 H THR 22 H THR 22 -8.320 5.142 8.434
145 HA THR 22 HA THR 22 -7.141 5.371 5.752
146 HB THR 22 HB THR 22 -9.291 3.424 6.705
147 HG1 THR 22 HG1 THR 22 -6.362 3.458 6.845
148 1HG2 THR 22 1HG2 THR 22 -8.618 3.638 4.206
149 2HG2 THR 22 2HG2 THR 22 -7.016 3.046 4.703
150 3HG2 THR 22 3HG2 THR 22 -8.452 2.019 4.927
151 H PHE 23 H PHE 23 -9.131 7.169 7.540
152 HA PHE 23 HA PHE 23 -11.128 7.430 5.410
153 1HB PHE 23 1HB PHE 23 -12.351 8.690 7.285
154 2HB PHE 23 2HB PHE 23 -12.052 7.003 7.655
155 HD1 PHE 23 HD1 PHE 23 -10.731 10.424 8.232
156 HD2 PHE 23 HD2 PHE 23 -10.848 6.401 9.575
157 HE1 PHE 23 HE1 PHE 23 -9.561 11.097 10.348
158 HE2 PHE 23 HE2 PHE 23 -9.678 7.073 11.692
159 HZ PHE 23 HZ PHE 23 -9.048 9.413 12.053
Start of MODEL 10
1 H GLU 1 H GLU 1 1.411 -4.901 19.661
2 HA GLU 1 HA GLU 1 0.287 -6.914 20.285
3 1HB GLU 1 1HB GLU 1 -0.856 -4.215 20.685
4 2HB GLU 1 2HB GLU 1 -2.020 -5.499 20.942
5 1HG GLU 1 1HG GLU 1 -0.462 -6.618 22.531
6 2HG GLU 1 2HG GLU 1 0.740 -5.375 22.248
7 H ASN 2 H ASN 2 -1.945 -4.798 18.329
8 HA ASN 2 HA ASN 2 -3.717 -6.873 17.816
9 1HB ASN 2 1HB ASN 2 -3.183 -4.286 16.263
10 2HB ASN 2 2HB ASN 2 -4.582 -5.310 16.008
11 1HD2 ASN 2 2HD2 ASN 2 -6.091 -5.616 17.709
12 2HD2 ASN 2 1HD2 ASN 2 -6.308 -4.430 18.953
13 H PHE 3 H PHE 3 -4.237 -7.242 15.202
14 HA PHE 3 HA PHE 3 -1.725 -8.290 14.142
15 1HB PHE 3 1HB PHE 3 -4.363 -9.279 14.511
16 2HB PHE 3 2HB PHE 3 -4.311 -8.912 12.799
17 HD1 PHE 3 HD1 PHE 3 -2.467 -10.764 15.446
18 HD2 PHE 3 HD2 PHE 3 -3.351 -10.428 11.309
19 HE1 PHE 3 HE1 PHE 3 -1.287 -12.937 15.017
20 HE2 PHE 3 HE2 PHE 3 -2.171 -12.601 10.881
21 HZ PHE 3 HZ PHE 3 -1.154 -13.830 12.740
22 H ASN 4 H ASN 4 -1.927 -8.464 11.533
23 HA ASN 4 HA ASN 4 -1.841 -7.414 9.641
24 1HB ASN 4 1HB ASN 4 -4.300 -7.108 9.871
25 2HB ASN 4 2HB ASN 4 -4.057 -5.658 10.823
26 1HD2 ASN 4 1HD2 ASN 4 -4.376 -3.870 9.765
27 2HD2 ASN 4 2HD2 ASN 4 -4.052 -3.556 8.093
28 H GLY 5 H GLY 5 0.034 -6.650 11.639
29 1HA GLY 5 1HA GLY 5 1.716 -5.007 11.357
30 2HA GLY 5 2HA GLY 5 0.493 -3.825 10.936
31 H GLY 6 H GLY 6 -1.428 -4.512 13.048
32 1HA GLY 6 1HA GLY 6 -1.352 -4.677 15.466
33 2HA GLY 6 2HA GLY 6 0.109 -3.708 15.445
34 H CYS 7 H CYS 7 -3.084 -3.384 13.730
35 HA CYS 7 HA CYS 7 -3.137 -0.624 14.679
36 1HB CYS 7 1HB CYS 7 -4.534 -1.979 12.367
37 2HB CYS 7 2HB CYS 7 -4.894 -0.348 12.894
38 H LEU 8 H LEU 8 -5.763 0.028 14.717
39 HA LEU 8 HA LEU 8 -6.779 -1.658 16.842
40 1HB LEU 8 1HB LEU 8 -6.726 0.678 17.272
41 2HB LEU 8 2HB LEU 8 -7.537 1.052 15.764
42 HG LEU 8 HG LEU 8 -9.593 -0.054 16.610
43 1HD1 LEU 8 1HD1 LEU 8 -8.291 -1.542 18.231
44 2HD1 LEU 8 2HD1 LEU 8 -8.290 -0.142 19.331
45 3HD1 LEU 8 3HD1 LEU 8 -9.831 -0.858 18.802
46 1HD2 LEU 8 1HD2 LEU 8 -8.369 2.309 17.990
47 2HD2 LEU 8 2HD2 LEU 8 -9.730 2.229 16.846
48 3HD2 LEU 8 3HD2 LEU 8 -9.951 1.696 18.529
49 H ALA 9 H ALA 9 -7.965 -0.268 13.700
50 HA ALA 9 HA ALA 9 -8.916 -2.475 12.549
51 1HB ALA 9 1HB ALA 9 -10.701 -1.646 14.819
52 2HB ALA 9 2HB ALA 9 -11.455 -2.240 13.320
53 3HB ALA 9 3HB ALA 9 -10.313 -3.274 14.212
54 H GLY 10 H GLY 10 -8.617 -1.327 10.661
55 1HA GLY 10 1HA GLY 10 -10.037 -0.186 9.036
56 2HA GLY 10 2HA GLY 10 -10.407 0.998 10.274
57 H TYR 11 H TYR 11 -7.697 1.149 11.425
58 HA TYR 11 HA TYR 11 -6.647 3.158 9.798
59 1HB TYR 11 1HB TYR 11 -5.494 1.322 11.989
60 2HB TYR 11 2HB TYR 11 -4.662 2.759 11.425
61 HD1 TYR 11 HD1 TYR 11 -5.917 5.023 11.659
62 HD2 TYR 11 HD2 TYR 11 -7.044 1.464 13.748
63 HE1 TYR 11 HE1 TYR 11 -7.182 6.417 13.368
64 HE2 TYR 11 HE2 TYR 11 -8.304 2.870 15.450
65 HH TYR 11 HH TYR 11 -9.167 4.889 15.827
66 H MET 12 H MET 12 -4.525 3.241 8.718
67 HA MET 12 HA MET 12 -3.909 0.642 7.544
68 1HB MET 12 1HB MET 12 -2.916 2.245 5.680
69 2HB MET 12 2HB MET 12 -4.652 2.019 5.754
70 1HG MET 12 1HG MET 12 -5.040 4.153 6.658
71 2HG MET 12 2HG MET 12 -3.459 4.243 7.410
72 1HE MET 12 1HE MET 12 -3.917 6.784 6.329
73 2HE MET 12 2HE MET 12 -2.236 6.273 6.612
74 3HE MET 12 3HE MET 12 -2.672 7.103 5.098
75 H ARG 13 H ARG 13 -1.588 0.308 6.890
76 HA ARG 13 HA ARG 13 0.087 1.512 8.918
77 1HB ARG 13 1HB ARG 13 1.653 -0.379 8.409
78 2HB ARG 13 2HB ARG 13 0.059 -0.953 8.857
79 1HG ARG 13 1HG ARG 13 -0.035 -2.102 6.907
80 2HG ARG 13 2HG ARG 13 -0.060 -0.578 6.043
81 1HD ARG 13 1HD ARG 13 2.390 -0.542 5.900
82 2HD ARG 13 2HD ARG 13 2.521 -1.934 6.956
83 HE ARG 13 HE ARG 13 0.984 -2.968 4.967
84 1HH1 ARG 13 1HH1 ARG 13 3.909 -1.017 4.824
85 2HH1 ARG 13 2HH1 ARG 13 4.441 -1.695 3.322
86 1HH2 ARG 13 1HH2 ARG 13 1.686 -3.863 2.985
87 2HH2 ARG 13 2HH2 ARG 13 3.168 -3.324 2.268
88 H THR 14 H THR 14 1.075 3.380 8.171
89 HA THR 14 HA THR 14 1.507 3.946 5.464
90 HB THR 14 HB THR 14 2.889 5.820 6.456
91 HG1 THR 14 HG1 THR 14 3.015 5.675 8.855
92 1HG2 THR 14 1HG2 THR 14 0.262 5.777 6.575
93 2HG2 THR 14 2HG2 THR 14 0.501 5.351 8.287
94 3HG2 THR 14 3HG2 THR 14 1.126 6.894 7.660
95 H ALA 15 H ALA 15 4.178 4.880 5.336
96 HA ALA 15 HA ALA 15 5.447 2.357 4.740
97 1HB ALA 15 1HB ALA 15 5.391 4.888 3.579
98 2HB ALA 15 2HB ALA 15 7.005 4.811 4.324
99 3HB ALA 15 3HB ALA 15 6.505 3.566 3.154
100 H ASP 16 H ASP 16 4.992 3.942 7.554
101 HA ASP 16 HA ASP 16 7.735 3.449 8.414
102 1HB ASP 16 1HB ASP 16 6.820 5.835 8.604
103 2HB ASP 16 2HB ASP 16 5.652 5.229 9.760
104 H GLY 17 H GLY 17 4.484 2.399 8.450
105 1HA GLY 17 1HA GLY 17 3.761 0.456 9.490
106 2HA GLY 17 2HA GLY 17 4.999 0.627 10.718
107 H ARG 18 H ARG 18 3.929 3.722 10.500
108 HA ARG 18 HA ARG 18 2.537 3.565 12.892
109 1HB ARG 18 1HB ARG 18 2.617 5.814 10.817
110 2HB ARG 18 2HB ARG 18 2.038 6.002 12.460
111 1HG ARG 18 1HG ARG 18 4.785 4.822 12.085
112 2HG ARG 18 2HG ARG 18 4.594 6.536 11.770
113 1HD ARG 18 1HD ARG 18 3.201 6.195 14.177
114 2HD ARG 18 2HD ARG 18 4.546 5.085 14.351
115 HE ARG 18 HE ARG 18 6.038 6.906 14.401
116 1HH1 ARG 18 1HH1 ARG 18 2.859 7.995 13.355
117 2HH1 ARG 18 2HH1 ARG 18 3.258 9.677 13.466
118 1HH2 ARG 18 1HH2 ARG 18 6.565 9.125 14.547
119 2HH2 ARG 18 2HH2 ARG 18 5.380 10.324 14.148
120 H CYS 19 H CYS 19 0.479 2.753 13.159
121 HA CYS 19 HA CYS 19 -1.242 2.295 11.022
122 1HB CYS 19 1HB CYS 19 -1.748 2.408 14.000
123 2HB CYS 19 2HB CYS 19 -2.953 1.908 12.830
124 H LYS 20 H LYS 20 -1.884 4.057 9.775
125 HA LYS 20 HA LYS 20 -2.802 6.434 11.209
126 1HB LYS 20 1HB LYS 20 -1.334 5.972 8.760
127 2HB LYS 20 2HB LYS 20 -2.786 6.893 8.423
128 1HG LYS 20 1HG LYS 20 -1.206 8.564 8.988
129 2HG LYS 20 2HG LYS 20 -2.124 8.366 10.468
130 1HD LYS 20 1HD LYS 20 0.190 6.515 10.247
131 2HD LYS 20 2HD LYS 20 0.644 8.208 10.268
132 1HE LYS 20 1HE LYS 20 -1.426 7.423 12.280
133 2HE LYS 20 2HE LYS 20 0.160 6.720 12.529
134 1HZ LYS 20 1HZ LYS 20 1.047 9.006 12.300
135 2HZ LYS 20 2HZ LYS 20 -0.484 9.574 12.312
136 3HZ LYS 20 3HZ LYS 20 0.105 8.785 13.615
137 HA PRO 21 HA PRO 21 -6.911 5.799 10.027
138 1HB PRO 21 1HB PRO 21 -7.820 8.214 9.123
139 2HB PRO 21 2HB PRO 21 -7.620 7.840 10.823
140 1HG PRO 21 1HG PRO 21 -5.929 9.532 9.086
141 2HG PRO 21 2HG PRO 21 -6.002 9.484 10.836
142 1HD PRO 21 1HD PRO 21 -3.970 8.334 9.171
143 2HD PRO 21 2HD PRO 21 -4.104 8.187 10.912
144 H THR 22 H THR 22 -8.329 5.018 8.490
145 HA THR 22 HA THR 22 -7.233 5.302 5.771
146 HB THR 22 HB THR 22 -8.982 3.048 6.863
147 HG1 THR 22 HG1 THR 22 -6.860 2.045 7.230
148 1HG2 THR 22 1HG2 THR 22 -8.214 3.568 4.270
149 2HG2 THR 22 2HG2 THR 22 -6.811 2.635 4.846
150 3HG2 THR 22 3HG2 THR 22 -8.441 1.923 4.911
151 H PHE 23 H PHE 23 -9.397 6.800 7.618
152 HA PHE 23 HA PHE 23 -11.881 6.576 6.735
153 1HB PHE 23 1HB PHE 23 -10.281 9.202 6.704
154 2HB PHE 23 2HB PHE 23 -11.991 9.046 7.054
155 HD1 PHE 23 HD1 PHE 23 -11.917 6.703 8.915
156 HD2 PHE 23 HD2 PHE 23 -9.444 10.142 8.674
157 HE1 PHE 23 HE1 PHE 23 -11.399 6.501 11.362
158 HE2 PHE 23 HE2 PHE 23 -8.925 9.940 11.121
159 HZ PHE 23 HZ PHE 23 -9.909 8.123 12.436
Start of MODEL 11
1 H GLU 1 H GLU 1 -11.168 -9.797 13.117
2 HA GLU 1 HA GLU 1 -10.029 -10.029 15.204
3 1HB GLU 1 1HB GLU 1 -10.028 -12.553 15.335
4 2HB GLU 1 2HB GLU 1 -11.488 -11.870 14.648
5 1HG GLU 1 1HG GLU 1 -10.674 -12.337 12.357
6 2HG GLU 1 2HG GLU 1 -9.147 -12.920 12.989
7 H ASN 2 H ASN 2 -8.212 -11.036 12.296
8 HA ASN 2 HA ASN 2 -5.930 -11.780 13.813
9 1HB ASN 2 1HB ASN 2 -5.950 -11.117 10.837
10 2HB ASN 2 2HB ASN 2 -4.911 -12.252 11.676
11 1HD2 ASN 2 2HD2 ASN 2 -7.408 -12.033 9.630
12 2HD2 ASN 2 1HD2 ASN 2 -8.254 -13.513 9.932
13 H PHE 3 H PHE 3 -4.366 -10.325 14.546
14 HA PHE 3 HA PHE 3 -4.639 -7.599 14.274
15 1HB PHE 3 1HB PHE 3 -2.584 -7.603 15.506
16 2HB PHE 3 2HB PHE 3 -3.225 -9.194 15.860
17 HD1 PHE 3 HD1 PHE 3 -2.364 -11.166 14.511
18 HD2 PHE 3 HD2 PHE 3 -0.500 -7.355 14.442
19 HE1 PHE 3 HE1 PHE 3 -0.260 -12.213 13.628
20 HE2 PHE 3 HE2 PHE 3 1.604 -8.402 13.558
21 HZ PHE 3 HZ PHE 3 1.700 -10.818 13.162
22 H ASN 4 H ASN 4 -4.213 -6.171 12.657
23 HA ASN 4 HA ASN 4 -2.796 -7.207 10.372
24 1HB ASN 4 1HB ASN 4 -4.936 -6.011 9.989
25 2HB ASN 4 2HB ASN 4 -4.338 -4.601 10.841
26 1HD2 ASN 4 2HD2 ASN 4 -3.749 -3.019 9.590
27 2HD2 ASN 4 1HD2 ASN 4 -3.033 -3.124 8.016
28 H GLY 5 H GLY 5 -1.037 -6.913 12.494
29 1HA GLY 5 1HA GLY 5 1.156 -6.001 12.343
30 2HA GLY 5 2HA GLY 5 0.482 -4.496 11.751
31 H GLY 6 H GLY 6 -1.749 -4.287 13.627
32 1HA GLY 6 1HA GLY 6 -1.680 -4.521 16.178
33 2HA GLY 6 2HA GLY 6 -0.211 -3.574 16.038
34 H CYS 7 H CYS 7 -3.309 -3.345 14.165
35 HA CYS 7 HA CYS 7 -3.380 -0.528 14.909
36 1HB CYS 7 1HB CYS 7 -4.837 -2.009 12.709
37 2HB CYS 7 2HB CYS 7 -4.965 -0.292 13.035
38 H LEU 8 H LEU 8 -6.049 0.094 14.703
39 HA LEU 8 HA LEU 8 -7.141 -1.349 16.969
40 1HB LEU 8 1HB LEU 8 -7.110 1.023 17.145
41 2HB LEU 8 2HB LEU 8 -7.862 1.224 15.575
42 HG LEU 8 HG LEU 8 -9.950 0.227 16.444
43 1HD1 LEU 8 1HD1 LEU 8 -8.825 -1.173 18.201
44 2HD1 LEU 8 2HD1 LEU 8 -8.663 0.303 19.182
45 3HD1 LEU 8 3HD1 LEU 8 -10.279 -0.301 18.743
46 1HD2 LEU 8 1HD2 LEU 8 -8.751 2.741 17.397
47 2HD2 LEU 8 2HD2 LEU 8 -10.315 2.433 16.607
48 3HD2 LEU 8 3HD2 LEU 8 -10.137 2.168 18.358
49 H ALA 9 H ALA 9 -8.197 -0.304 13.652
50 HA ALA 9 HA ALA 9 -9.088 -2.627 12.697
51 1HB ALA 9 1HB ALA 9 -10.822 -1.738 14.919
52 2HB ALA 9 2HB ALA 9 -11.698 -2.116 13.416
53 3HB ALA 9 3HB ALA 9 -10.654 -3.345 14.171
54 H GLY 10 H GLY 10 -8.549 -1.510 10.793
55 1HA GLY 10 1HA GLY 10 -9.956 -0.603 8.967
56 2HA GLY 10 2HA GLY 10 -10.401 0.683 10.070
57 H TYR 11 H TYR 11 -7.818 1.069 11.351
58 HA TYR 11 HA TYR 11 -6.684 2.911 9.624
59 1HB TYR 11 1HB TYR 11 -5.621 1.254 11.994
60 2HB TYR 11 2HB TYR 11 -4.759 2.641 11.356
61 HD1 TYR 11 HD1 TYR 11 -7.730 1.543 13.240
62 HD2 TYR 11 HD2 TYR 11 -5.530 4.912 11.781
63 HE1 TYR 11 HE1 TYR 11 -9.056 3.081 14.770
64 HE2 TYR 11 HE2 TYR 11 -6.864 6.437 13.316
65 HH TYR 11 HH TYR 11 -8.438 5.497 15.866
66 H MET 12 H MET 12 -4.533 2.948 8.614
67 HA MET 12 HA MET 12 -3.785 0.269 7.726
68 1HB MET 12 1HB MET 12 -2.883 1.656 5.673
69 2HB MET 12 2HB MET 12 -4.612 1.396 5.789
70 1HG MET 12 1HG MET 12 -5.059 3.616 6.329
71 2HG MET 12 2HG MET 12 -3.546 3.830 7.187
72 1HE MET 12 1HE MET 12 -3.302 6.042 6.276
73 2HE MET 12 2HE MET 12 -2.843 6.477 4.611
74 3HE MET 12 3HE MET 12 -4.546 6.150 5.008
75 H ARG 13 H ARG 13 -1.432 0.032 7.089
76 HA ARG 13 HA ARG 13 0.134 1.511 9.014
77 1HB ARG 13 1HB ARG 13 0.055 -1.155 8.568
78 2HB ARG 13 2HB ARG 13 1.283 -0.757 7.383
79 1HG ARG 13 1HG ARG 13 2.769 -0.864 9.105
80 2HG ARG 13 2HG ARG 13 2.139 0.696 9.594
81 1HD ARG 13 1HD ARG 13 1.524 -0.292 11.551
82 2HD ARG 13 2HD ARG 13 0.256 -1.098 10.649
83 HE ARG 13 HE ARG 13 2.349 -2.766 10.165
84 1HH1 ARG 13 1HH1 ARG 13 1.223 -1.303 13.161
85 2HH1 ARG 13 2HH1 ARG 13 1.787 -2.602 14.157
86 1HH2 ARG 13 1HH2 ARG 13 3.094 -4.481 11.480
87 2HH2 ARG 13 2HH2 ARG 13 2.859 -4.422 13.195
88 H THR 14 H THR 14 0.904 3.424 8.120
89 HA THR 14 HA THR 14 1.311 3.872 5.410
90 HB THR 14 HB THR 14 2.747 5.808 6.391
91 HG1 THR 14 HG1 THR 14 3.124 4.269 8.330
92 1HG2 THR 14 1HG2 THR 14 -0.117 5.192 7.160
93 2HG2 THR 14 2HG2 THR 14 0.690 6.582 7.924
94 3HG2 THR 14 3HG2 THR 14 0.512 6.520 6.154
95 H ALA 15 H ALA 15 3.888 4.936 5.113
96 HA ALA 15 HA ALA 15 5.311 2.464 4.665
97 1HB ALA 15 1HB ALA 15 5.288 5.222 3.626
98 2HB ALA 15 2HB ALA 15 6.924 4.548 3.815
99 3HB ALA 15 3HB ALA 15 5.722 3.699 2.814
100 H ASP 16 H ASP 16 4.822 4.093 7.395
101 HA ASP 16 HA ASP 16 7.638 4.042 8.145
102 1HB ASP 16 1HB ASP 16 5.882 6.124 8.415
103 2HB ASP 16 2HB ASP 16 5.595 5.308 9.939
104 H GLY 17 H GLY 17 4.479 2.622 8.470
105 1HA GLY 17 1HA GLY 17 4.123 0.556 9.494
106 2HA GLY 17 2HA GLY 17 5.455 0.852 10.594
107 H ARG 18 H ARG 18 3.731 3.750 10.336
108 HA ARG 18 HA ARG 18 2.579 3.275 12.908
109 1HB ARG 18 1HB ARG 18 2.542 5.796 11.174
110 2HB ARG 18 2HB ARG 18 2.101 5.721 12.868
111 1HG ARG 18 1HG ARG 18 4.391 5.078 13.495
112 2HG ARG 18 2HG ARG 18 4.858 4.941 11.812
113 1HD ARG 18 1HD ARG 18 5.413 7.141 11.798
114 2HD ARG 18 2HD ARG 18 3.740 7.559 12.111
115 HE ARG 18 HE ARG 18 4.850 6.767 14.595
116 1HH1 ARG 18 1HH1 ARG 18 5.319 9.318 12.216
117 2HH1 ARG 18 2HH1 ARG 18 5.888 10.471 13.377
118 1HH2 ARG 18 1HH2 ARG 18 5.600 8.288 16.126
119 2HH2 ARG 18 2HH2 ARG 18 6.049 9.881 15.616
120 H CYS 19 H CYS 19 0.529 2.423 13.073
121 HA CYS 19 HA CYS 19 -1.181 2.122 10.936
122 1HB CYS 19 1HB CYS 19 -1.766 2.162 13.901
123 2HB CYS 19 2HB CYS 19 -2.924 1.675 12.681
124 H LYS 20 H LYS 20 -1.680 3.983 9.739
125 HA LYS 20 HA LYS 20 -2.621 6.309 11.228
126 1HB LYS 20 1HB LYS 20 -1.336 5.844 8.599
127 2HB LYS 20 2HB LYS 20 -2.580 7.078 8.615
128 1HG LYS 20 1HG LYS 20 -1.073 7.524 10.982
129 2HG LYS 20 2HG LYS 20 0.118 7.163 9.748
130 1HD LYS 20 1HD LYS 20 -1.275 8.857 8.265
131 2HD LYS 20 2HD LYS 20 -1.930 9.400 9.796
132 1HE LYS 20 1HE LYS 20 1.063 9.217 9.215
133 2HE LYS 20 2HE LYS 20 0.125 10.682 9.003
134 1HZ LYS 20 1HZ LYS 20 -0.557 10.023 11.459
135 2HZ LYS 20 2HZ LYS 20 0.948 9.389 11.434
136 3HZ LYS 20 3HZ LYS 20 0.726 10.976 11.121
137 HA PRO 21 HA PRO 21 -6.731 5.711 10.051
138 1HB PRO 21 1HB PRO 21 -7.660 8.219 9.489
139 2HB PRO 21 2HB PRO 21 -7.446 7.620 11.122
140 1HG PRO 21 1HG PRO 21 -5.777 9.542 9.618
141 2HG PRO 21 2HG PRO 21 -5.837 9.258 11.346
142 1HD PRO 21 1HD PRO 21 -3.810 8.357 9.528
143 2HD PRO 21 2HD PRO 21 -3.932 7.976 11.235
144 H THR 22 H THR 22 -8.149 5.126 8.433
145 HA THR 22 HA THR 22 -6.930 5.332 5.815
146 HB THR 22 HB THR 22 -9.608 4.052 6.458
147 HG1 THR 22 HG1 THR 22 -6.859 3.298 7.136
148 1HG2 THR 22 1HG2 THR 22 -7.734 3.970 4.279
149 2HG2 THR 22 2HG2 THR 22 -7.636 2.400 5.113
150 3HG2 THR 22 3HG2 THR 22 -9.198 2.978 4.486
151 H PHE 23 H PHE 23 -8.487 7.566 7.556
152 HA PHE 23 HA PHE 23 -10.093 8.445 5.260
153 1HB PHE 23 1HB PHE 23 -11.296 9.780 7.081
154 2HB PHE 23 2HB PHE 23 -11.420 8.046 7.309
155 HD1 PHE 23 HD1 PHE 23 -9.266 10.920 8.325
156 HD2 PHE 23 HD2 PHE 23 -10.929 7.164 9.388
157 HE1 PHE 23 HE1 PHE 23 -8.323 11.157 10.639
158 HE2 PHE 23 HE2 PHE 23 -9.986 7.401 11.702
159 HZ PHE 23 HZ PHE 23 -8.693 9.394 12.300
Start of MODEL 12
1 H GLU 1 H GLU 1 -8.978 -11.239 14.664
2 HA GLU 1 HA GLU 1 -8.634 -11.890 12.393
3 1HB GLU 1 1HB GLU 1 -9.953 -9.703 13.169
4 2HB GLU 1 2HB GLU 1 -8.681 -8.874 12.294
5 1HG GLU 1 1HG GLU 1 -10.486 -9.250 10.728
6 2HG GLU 1 2HG GLU 1 -9.187 -10.338 10.281
7 H ASN 2 H ASN 2 -6.145 -12.462 12.876
8 HA ASN 2 HA ASN 2 -4.090 -12.409 12.188
9 1HB ASN 2 1HB ASN 2 -5.632 -11.299 9.919
10 2HB ASN 2 2HB ASN 2 -3.970 -10.744 9.907
11 1HD2 ASN 2 2HD2 ASN 2 -2.436 -12.023 9.163
12 2HD2 ASN 2 1HD2 ASN 2 -2.584 -13.707 8.790
13 H PHE 3 H PHE 3 -2.128 -10.831 11.633
14 HA PHE 3 HA PHE 3 -2.667 -8.243 12.915
15 1HB PHE 3 1HB PHE 3 -1.300 -9.570 14.405
16 2HB PHE 3 2HB PHE 3 -0.437 -10.322 13.078
17 HD1 PHE 3 HD1 PHE 3 -0.677 -7.345 15.195
18 HD2 PHE 3 HD2 PHE 3 1.444 -9.208 12.027
19 HE1 PHE 3 HE1 PHE 3 1.187 -5.686 15.468
20 HE2 PHE 3 HE2 PHE 3 3.308 -7.549 12.299
21 HZ PHE 3 HZ PHE 3 3.157 -5.808 14.016
22 H ASN 4 H ASN 4 -2.726 -6.770 11.255
23 HA ASN 4 HA ASN 4 -0.774 -7.116 9.143
24 1HB ASN 4 1HB ASN 4 -2.171 -5.148 8.121
25 2HB ASN 4 2HB ASN 4 -2.930 -6.725 8.203
26 1HD2 ASN 4 2HD2 ASN 4 -3.114 -3.473 9.041
27 2HD2 ASN 4 1HD2 ASN 4 -4.463 -3.514 10.127
28 H GLY 5 H GLY 5 0.589 -6.392 11.352
29 1HA GLY 5 1HA GLY 5 2.243 -4.668 11.468
30 2HA GLY 5 2HA GLY 5 1.020 -3.487 11.046
31 H GLY 6 H GLY 6 -1.129 -4.449 12.747
32 1HA GLY 6 1HA GLY 6 -1.424 -4.944 15.092
33 2HA GLY 6 2HA GLY 6 0.036 -4.037 15.433
34 H CYS 7 H CYS 7 -2.994 -3.454 13.494
35 HA CYS 7 HA CYS 7 -3.025 -0.759 14.587
36 1HB CYS 7 1HB CYS 7 -4.371 -2.054 12.224
37 2HB CYS 7 2HB CYS 7 -4.910 -0.507 12.850
38 H LEU 8 H LEU 8 -5.626 -0.056 14.725
39 HA LEU 8 HA LEU 8 -6.622 -1.781 16.822
40 1HB LEU 8 1HB LEU 8 -6.527 0.545 17.301
41 2HB LEU 8 2HB LEU 8 -7.371 0.960 15.822
42 HG LEU 8 HG LEU 8 -9.432 -0.054 16.674
43 1HD1 LEU 8 1HD1 LEU 8 -8.360 -1.810 18.058
44 2HD1 LEU 8 2HD1 LEU 8 -7.920 -0.563 19.250
45 3HD1 LEU 8 3HD1 LEU 8 -9.634 -0.913 18.918
46 1HD2 LEU 8 1HD2 LEU 8 -8.187 2.306 17.614
47 2HD2 LEU 8 2HD2 LEU 8 -9.925 1.937 17.514
48 3HD2 LEU 8 3HD2 LEU 8 -9.022 1.570 19.004
49 H ALA 9 H ALA 9 -7.860 -0.309 13.738
50 HA ALA 9 HA ALA 9 -8.868 -2.477 12.562
51 1HB ALA 9 1HB ALA 9 -10.534 -1.733 14.931
52 2HB ALA 9 2HB ALA 9 -11.399 -2.156 13.434
53 3HB ALA 9 3HB ALA 9 -10.273 -3.322 14.169
54 H GLY 10 H GLY 10 -8.555 -1.252 10.714
55 1HA GLY 10 1HA GLY 10 -10.022 -0.067 9.146
56 2HA GLY 10 2HA GLY 10 -10.338 1.093 10.421
57 H TYR 11 H TYR 11 -7.612 1.199 11.509
58 HA TYR 11 HA TYR 11 -6.567 3.223 9.912
59 1HB TYR 11 1HB TYR 11 -5.407 1.294 12.016
60 2HB TYR 11 2HB TYR 11 -4.524 2.699 11.451
61 HD1 TYR 11 HD1 TYR 11 -6.015 4.978 11.566
62 HD2 TYR 11 HD2 TYR 11 -6.536 1.516 14.024
63 HE1 TYR 11 HE1 TYR 11 -7.156 6.399 13.339
64 HE2 TYR 11 HE2 TYR 11 -7.675 2.949 15.789
65 HH TYR 11 HH TYR 11 -7.724 5.247 16.481
66 H MET 12 H MET 12 -4.493 3.311 8.751
67 HA MET 12 HA MET 12 -3.976 0.749 7.456
68 1HB MET 12 1HB MET 12 -2.956 2.443 5.664
69 2HB MET 12 2HB MET 12 -4.692 2.212 5.736
70 1HG MET 12 1HG MET 12 -5.019 4.255 6.986
71 2HG MET 12 2HG MET 12 -3.310 4.396 7.352
72 1HE MET 12 1HE MET 12 -2.354 6.172 6.622
73 2HE MET 12 2HE MET 12 -2.344 6.926 5.010
74 3HE MET 12 3HE MET 12 -3.723 7.184 6.105
75 H ARG 13 H ARG 13 -1.692 0.345 6.751
76 HA ARG 13 HA ARG 13 0.073 1.385 8.789
77 1HB ARG 13 1HB ARG 13 0.230 -0.973 8.763
78 2HB ARG 13 2HB ARG 13 0.045 -1.072 7.023
79 1HG ARG 13 1HG ARG 13 2.292 -0.717 6.617
80 2HG ARG 13 2HG ARG 13 2.468 0.409 7.947
81 1HD ARG 13 1HD ARG 13 3.660 -1.397 8.811
82 2HD ARG 13 2HD ARG 13 2.070 -1.773 9.445
83 HE ARG 13 HE ARG 13 1.873 -3.559 7.904
84 1HH1 ARG 13 1HH1 ARG 13 4.733 -1.633 7.203
85 2HH1 ARG 13 2HH1 ARG 13 5.399 -2.790 6.099
86 1HH2 ARG 13 1HH2 ARG 13 2.750 -5.087 6.448
87 2HH2 ARG 13 2HH2 ARG 13 4.263 -4.768 5.667
88 H THR 14 H THR 14 1.085 3.276 8.132
89 HA THR 14 HA THR 14 1.478 3.998 5.460
90 HB THR 14 HB THR 14 2.763 5.837 6.467
91 HG1 THR 14 HG1 THR 14 2.606 4.197 8.887
92 1HG2 THR 14 1HG2 THR 14 0.226 4.944 7.632
93 2HG2 THR 14 2HG2 THR 14 1.231 5.749 8.861
94 3HG2 THR 14 3HG2 THR 14 0.802 6.606 7.360
95 H ALA 15 H ALA 15 4.323 4.873 5.739
96 HA ALA 15 HA ALA 15 5.459 2.352 4.805
97 1HB ALA 15 1HB ALA 15 5.440 4.543 3.450
98 2HB ALA 15 2HB ALA 15 6.668 5.126 4.600
99 3HB ALA 15 3HB ALA 15 6.998 3.695 3.595
100 H ASP 16 H ASP 16 5.084 3.875 7.703
101 HA ASP 16 HA ASP 16 7.769 3.100 8.539
102 1HB ASP 16 1HB ASP 16 6.186 5.519 9.028
103 2HB ASP 16 2HB ASP 16 6.615 4.751 10.543
104 H GLY 17 H GLY 17 4.497 2.299 8.508
105 1HA GLY 17 1HA GLY 17 3.608 0.442 9.583
106 2HA GLY 17 2HA GLY 17 4.779 0.605 10.877
107 H ARG 18 H ARG 18 3.914 3.739 10.473
108 HA ARG 18 HA ARG 18 2.464 3.855 12.788
109 1HB ARG 18 1HB ARG 18 2.389 5.872 10.488
110 2HB ARG 18 2HB ARG 18 2.025 6.215 12.167
111 1HG ARG 18 1HG ARG 18 4.437 5.342 12.674
112 2HG ARG 18 2HG ARG 18 4.717 5.492 10.950
113 1HD ARG 18 1HD ARG 18 3.455 7.929 11.761
114 2HD ARG 18 2HD ARG 18 4.670 7.584 12.976
115 HE ARG 18 HE ARG 18 6.364 7.902 11.370
116 1HH1 ARG 18 1HH1 ARG 18 3.229 7.713 9.783
117 2HH1 ARG 18 2HH1 ARG 18 3.835 8.226 8.244
118 1HH2 ARG 18 1HH2 ARG 18 7.163 8.580 9.340
119 2HH2 ARG 18 2HH2 ARG 18 6.088 8.722 7.990
120 H CYS 19 H CYS 19 0.435 3.005 13.144
121 HA CYS 19 HA CYS 19 -1.313 2.403 11.035
122 1HB CYS 19 1HB CYS 19 -1.696 2.505 14.028
123 2HB CYS 19 2HB CYS 19 -2.959 2.008 12.921
124 H LYS 20 H LYS 20 -1.850 4.250 9.799
125 HA LYS 20 HA LYS 20 -2.911 6.543 11.256
126 1HB LYS 20 1HB LYS 20 -1.357 6.191 8.864
127 2HB LYS 20 2HB LYS 20 -2.855 6.998 8.449
128 1HG LYS 20 1HG LYS 20 -2.249 8.377 10.718
129 2HG LYS 20 2HG LYS 20 -0.626 7.924 10.235
130 1HD LYS 20 1HD LYS 20 -1.969 8.800 7.858
131 2HD LYS 20 2HD LYS 20 -2.352 9.969 9.105
132 1HE LYS 20 1HE LYS 20 0.217 9.916 9.653
133 2HE LYS 20 2HE LYS 20 0.392 9.145 8.088
134 1HZ LYS 20 1HZ LYS 20 -1.253 11.270 7.655
135 2HZ LYS 20 2HZ LYS 20 -0.116 11.850 8.674
136 3HZ LYS 20 3HZ LYS 20 0.328 11.170 7.257
137 HA PRO 21 HA PRO 21 -6.979 5.825 9.985
138 1HB PRO 21 1HB PRO 21 -7.924 8.204 9.027
139 2HB PRO 21 2HB PRO 21 -7.749 7.862 10.736
140 1HG PRO 21 1HG PRO 21 -6.063 9.564 9.004
141 2HG PRO 21 2HG PRO 21 -6.168 9.541 10.754
142 1HD PRO 21 1HD PRO 21 -4.079 8.413 9.146
143 2HD PRO 21 2HD PRO 21 -4.245 8.290 10.886
144 H THR 22 H THR 22 -8.347 4.986 8.434
145 HA THR 22 HA THR 22 -7.201 5.247 5.733
146 HB THR 22 HB THR 22 -8.938 2.986 6.834
147 HG1 THR 22 HG1 THR 22 -6.777 2.016 7.198
148 1HG2 THR 22 1HG2 THR 22 -8.285 3.394 4.254
149 2HG2 THR 22 2HG2 THR 22 -6.726 2.723 4.791
150 3HG2 THR 22 3HG2 THR 22 -8.214 1.763 4.964
151 H PHE 23 H PHE 23 -9.426 6.744 7.507
152 HA PHE 23 HA PHE 23 -11.887 6.468 6.571
153 1HB PHE 23 1HB PHE 23 -10.324 9.116 6.537
154 2HB PHE 23 2HB PHE 23 -12.039 8.943 6.847
155 HD1 PHE 23 HD1 PHE 23 -11.958 6.612 8.740
156 HD2 PHE 23 HD2 PHE 23 -9.570 10.113 8.517
157 HE1 PHE 23 HE1 PHE 23 -11.498 6.455 11.202
158 HE2 PHE 23 HE2 PHE 23 -9.110 9.956 10.981
159 HZ PHE 23 HZ PHE 23 -10.079 8.127 12.293
Start of MODEL 13
1 H GLU 1 H GLU 1 0.746 -7.646 23.047
2 HA GLU 1 HA GLU 1 -1.298 -6.411 23.074
3 1HB GLU 1 1HB GLU 1 1.345 -4.981 22.921
4 2HB GLU 1 2HB GLU 1 -0.105 -4.001 23.008
5 1HG GLU 1 1HG GLU 1 0.235 -6.308 24.941
6 2HG GLU 1 2HG GLU 1 1.102 -4.814 25.234
7 H ASN 2 H ASN 2 -2.361 -7.035 20.990
8 HA ASN 2 HA ASN 2 -2.502 -4.706 19.319
9 1HB ASN 2 1HB ASN 2 -2.059 -7.463 18.069
10 2HB ASN 2 2HB ASN 2 -2.172 -5.936 17.218
11 1HD2 ASN 2 1HD2 ASN 2 -0.174 -8.147 18.851
12 2HD2 ASN 2 2HD2 ASN 2 1.322 -7.275 18.803
13 H PHE 3 H PHE 3 -4.438 -5.027 17.700
14 HA PHE 3 HA PHE 3 -6.468 -6.631 19.069
15 1HB PHE 3 1HB PHE 3 -6.298 -4.053 17.496
16 2HB PHE 3 2HB PHE 3 -7.771 -4.976 17.276
17 HD1 PHE 3 HD1 PHE 3 -5.778 -3.031 19.646
18 HD2 PHE 3 HD2 PHE 3 -9.355 -5.247 19.099
19 HE1 PHE 3 HE1 PHE 3 -6.708 -2.054 21.763
20 HE2 PHE 3 HE2 PHE 3 -10.285 -4.270 21.216
21 HZ PHE 3 HZ PHE 3 -8.949 -2.685 22.522
22 H ASN 4 H ASN 4 -6.037 -5.391 15.681
23 HA ASN 4 HA ASN 4 -6.880 -8.028 14.803
24 1HB ASN 4 1HB ASN 4 -7.144 -6.734 12.542
25 2HB ASN 4 2HB ASN 4 -8.298 -6.384 13.814
26 1HD2 ASN 4 2HD2 ASN 4 -5.134 -5.375 12.554
27 2HD2 ASN 4 1HD2 ASN 4 -5.302 -3.677 12.855
28 H GLY 5 H GLY 5 -4.202 -7.788 15.730
29 1HA GLY 5 1HA GLY 5 -2.356 -8.872 14.659
30 2HA GLY 5 2HA GLY 5 -2.689 -7.963 13.198
31 H GLY 6 H GLY 6 -3.238 -5.387 14.555
32 1HA GLY 6 1HA GLY 6 -1.015 -4.671 16.180
33 2HA GLY 6 2HA GLY 6 -0.729 -4.237 14.506
34 H CYS 7 H CYS 7 -2.614 -3.028 13.368
35 HA CYS 7 HA CYS 7 -3.089 -0.681 14.694
36 1HB CYS 7 1HB CYS 7 -4.382 -1.985 12.316
37 2HB CYS 7 2HB CYS 7 -4.994 -0.464 12.934
38 H LEU 8 H LEU 8 -5.650 0.100 14.837
39 HA LEU 8 HA LEU 8 -6.700 -1.552 16.954
40 1HB LEU 8 1HB LEU 8 -6.593 0.794 17.337
41 2HB LEU 8 2HB LEU 8 -7.428 1.151 15.838
42 HG LEU 8 HG LEU 8 -9.503 0.228 16.710
43 1HD1 LEU 8 1HD1 LEU 8 -7.744 -0.692 18.947
44 2HD1 LEU 8 2HD1 LEU 8 -9.437 -0.272 19.299
45 3HD1 LEU 8 3HD1 LEU 8 -9.064 -1.536 18.102
46 1HD2 LEU 8 1HD2 LEU 8 -9.010 2.588 17.127
47 2HD2 LEU 8 2HD2 LEU 8 -9.970 1.881 18.448
48 3HD2 LEU 8 3HD2 LEU 8 -8.226 2.161 18.666
49 H ALA 9 H ALA 9 -7.913 -0.187 13.811
50 HA ALA 9 HA ALA 9 -8.919 -2.392 12.705
51 1HB ALA 9 1HB ALA 9 -10.662 -1.499 14.986
52 2HB ALA 9 2HB ALA 9 -11.437 -2.126 13.512
53 3HB ALA 9 3HB ALA 9 -10.290 -3.143 14.417
54 H GLY 10 H GLY 10 -8.566 -1.215 10.827
55 1HA GLY 10 1HA GLY 10 -10.034 -0.086 9.207
56 2HA GLY 10 2HA GLY 10 -10.343 1.121 10.438
57 H TYR 11 H TYR 11 -7.630 1.261 11.534
58 HA TYR 11 HA TYR 11 -6.561 3.214 9.873
59 1HB TYR 11 1HB TYR 11 -5.418 1.340 12.035
60 2HB TYR 11 2HB TYR 11 -4.522 2.718 11.428
61 HD1 TYR 11 HD1 TYR 11 -6.002 5.012 11.467
62 HD2 TYR 11 HD2 TYR 11 -6.533 1.637 14.041
63 HE1 TYR 11 HE1 TYR 11 -7.129 6.498 13.195
64 HE2 TYR 11 HE2 TYR 11 -7.658 3.135 15.761
65 HH TYR 11 HH TYR 11 -8.597 6.357 15.003
66 H MET 12 H MET 12 -4.509 3.253 8.689
67 HA MET 12 HA MET 12 -4.000 0.645 7.486
68 1HB MET 12 1HB MET 12 -3.069 2.146 5.570
69 2HB MET 12 2HB MET 12 -4.807 2.164 5.796
70 1HG MET 12 1HG MET 12 -4.829 4.352 6.528
71 2HG MET 12 2HG MET 12 -3.343 4.175 7.438
72 1HE MET 12 1HE MET 12 -3.552 6.681 6.377
73 2HE MET 12 2HE MET 12 -2.841 7.092 4.798
74 3HE MET 12 3HE MET 12 -4.511 6.482 4.891
75 H ARG 13 H ARG 13 -1.684 0.345 6.648
76 HA ARG 13 HA ARG 13 0.073 1.321 8.724
77 1HB ARG 13 1HB ARG 13 0.412 -0.912 6.659
78 2HB ARG 13 2HB ARG 13 1.628 -0.492 7.849
79 1HG ARG 13 1HG ARG 13 -0.879 -0.804 9.241
80 2HG ARG 13 2HG ARG 13 -0.690 -2.184 8.177
81 1HD ARG 13 1HD ARG 13 1.873 -1.913 9.255
82 2HD ARG 13 2HD ARG 13 0.851 -1.455 10.603
83 HE ARG 13 HE ARG 13 0.059 -3.662 10.743
84 1HH1 ARG 13 1HH1 ARG 13 1.745 -3.206 7.688
85 2HH1 ARG 13 2HH1 ARG 13 1.727 -4.889 7.280
86 1HH2 ARG 13 1HH2 ARG 13 0.035 -5.883 10.205
87 2HH2 ARG 13 2HH2 ARG 13 0.748 -6.422 8.721
88 H THR 14 H THR 14 1.008 3.280 8.150
89 HA THR 14 HA THR 14 1.419 4.051 5.464
90 HB THR 14 HB THR 14 2.614 5.964 6.591
91 HG1 THR 14 HG1 THR 14 3.546 5.251 8.473
92 1HG2 THR 14 1HG2 THR 14 -0.111 5.205 7.019
93 2HG2 THR 14 2HG2 THR 14 0.518 5.712 8.604
94 3HG2 THR 14 3HG2 THR 14 0.594 6.827 7.218
95 H ALA 15 H ALA 15 4.043 5.176 5.546
96 HA ALA 15 HA ALA 15 5.510 2.739 4.941
97 1HB ALA 15 1HB ALA 15 5.289 4.682 3.329
98 2HB ALA 15 2HB ALA 15 6.282 5.640 4.454
99 3HB ALA 15 3HB ALA 15 6.963 4.189 3.681
100 H ASP 16 H ASP 16 4.858 3.773 7.758
101 HA ASP 16 HA ASP 16 7.639 3.831 8.621
102 1HB ASP 16 1HB ASP 16 5.654 5.856 8.999
103 2HB ASP 16 2HB ASP 16 5.847 5.076 10.556
104 H GLY 17 H GLY 17 4.974 1.981 8.354
105 1HA GLY 17 1HA GLY 17 4.297 0.104 9.408
106 2HA GLY 17 2HA GLY 17 5.594 0.304 10.570
107 H ARG 18 H ARG 18 3.714 3.180 10.270
108 HA ARG 18 HA ARG 18 2.715 2.784 12.888
109 1HB ARG 18 1HB ARG 18 3.018 5.010 10.970
110 2HB ARG 18 2HB ARG 18 1.501 5.107 11.843
111 1HG ARG 18 1HG ARG 18 3.281 4.451 13.876
112 2HG ARG 18 2HG ARG 18 4.278 5.453 12.840
113 1HD ARG 18 1HD ARG 18 3.072 7.365 13.296
114 2HD ARG 18 2HD ARG 18 1.534 6.524 13.295
115 HE ARG 18 HE ARG 18 2.955 5.639 15.587
116 1HH1 ARG 18 1HH1 ARG 18 1.554 8.621 14.352
117 2HH1 ARG 18 2HH1 ARG 18 1.247 9.279 15.925
118 1HH2 ARG 18 1HH2 ARG 18 2.550 6.506 17.663
119 2HH2 ARG 18 2HH2 ARG 18 1.818 8.067 17.821
120 H CYS 19 H CYS 19 0.204 4.080 12.873
121 HA CYS 19 HA CYS 19 -1.393 2.442 11.053
122 1HB CYS 19 1HB CYS 19 -1.766 2.730 14.035
123 2HB CYS 19 2HB CYS 19 -3.038 2.180 12.963
124 H LYS 20 H LYS 20 -1.894 4.230 9.709
125 HA LYS 20 HA LYS 20 -2.933 6.614 11.029
126 1HB LYS 20 1HB LYS 20 -1.450 6.068 8.595
127 2HB LYS 20 2HB LYS 20 -2.900 6.984 8.241
128 1HG LYS 20 1HG LYS 20 -2.177 8.447 10.329
129 2HG LYS 20 2HG LYS 20 -0.601 7.725 10.074
130 1HD LYS 20 1HD LYS 20 -0.528 8.565 7.760
131 2HD LYS 20 2HD LYS 20 -2.173 9.159 7.884
132 1HE LYS 20 1HE LYS 20 -0.860 11.098 8.267
133 2HE LYS 20 2HE LYS 20 -1.327 10.601 9.881
134 1HZ LYS 20 1HZ LYS 20 1.163 9.622 8.714
135 2HZ LYS 20 2HZ LYS 20 1.105 11.099 9.409
136 3HZ LYS 20 3HZ LYS 20 0.760 9.768 10.290
137 HA PRO 21 HA PRO 21 -7.014 5.846 9.837
138 1HB PRO 21 1HB PRO 21 -7.963 8.206 8.838
139 2HB PRO 21 2HB PRO 21 -7.772 7.900 10.552
140 1HG PRO 21 1HG PRO 21 -6.099 9.561 8.770
141 2HG PRO 21 2HG PRO 21 -6.189 9.576 10.520
142 1HD PRO 21 1HD PRO 21 -4.116 8.409 8.917
143 2HD PRO 21 2HD PRO 21 -4.266 8.323 10.660
144 H THR 22 H THR 22 -8.367 4.940 8.324
145 HA THR 22 HA THR 22 -7.256 5.153 5.606
146 HB THR 22 HB THR 22 -8.979 2.923 6.792
147 HG1 THR 22 HG1 THR 22 -6.865 3.381 7.908
148 1HG2 THR 22 1HG2 THR 22 -8.233 3.359 4.166
149 2HG2 THR 22 2HG2 THR 22 -6.837 2.433 4.768
150 3HG2 THR 22 3HG2 THR 22 -8.474 1.741 4.869
151 H PHE 23 H PHE 23 -9.465 6.696 7.361
152 HA PHE 23 HA PHE 23 -11.932 6.403 6.451
153 1HB PHE 23 1HB PHE 23 -10.364 9.047 6.347
154 2HB PHE 23 2HB PHE 23 -12.078 8.884 6.671
155 HD1 PHE 23 HD1 PHE 23 -11.962 6.578 8.609
156 HD2 PHE 23 HD2 PHE 23 -9.624 10.106 8.306
157 HE1 PHE 23 HE1 PHE 23 -11.487 6.474 11.072
158 HE2 PHE 23 HE2 PHE 23 -9.149 10.004 10.768
159 HZ PHE 23 HZ PHE 23 -10.086 8.189 12.122
Start of MODEL 14
1 H GLU 1 H GLU 1 -2.056 -17.874 11.312
2 HA GLU 1 HA GLU 1 -3.372 -15.880 11.272
3 1HB GLU 1 1HB GLU 1 -1.914 -16.848 13.636
4 2HB GLU 1 2HB GLU 1 -2.414 -15.179 13.818
5 1HG GLU 1 1HG GLU 1 -4.432 -16.045 14.442
6 2HG GLU 1 2HG GLU 1 -4.698 -16.286 12.726
7 H ASN 2 H ASN 2 -0.183 -15.047 12.821
8 HA ASN 2 HA ASN 2 1.022 -13.245 12.770
9 1HB ASN 2 1HB ASN 2 0.174 -13.624 9.938
10 2HB ASN 2 2HB ASN 2 0.706 -11.992 10.294
11 1HD2 ASN 2 2HD2 ASN 2 1.588 -15.284 9.884
12 2HD2 ASN 2 1HD2 ASN 2 3.304 -15.132 10.062
13 H PHE 3 H PHE 3 0.928 -10.668 12.172
14 HA PHE 3 HA PHE 3 -1.822 -9.808 12.743
15 1HB PHE 3 1HB PHE 3 0.840 -9.344 13.956
16 2HB PHE 3 2HB PHE 3 0.104 -7.822 13.494
17 HD1 PHE 3 HD1 PHE 3 -0.157 -10.732 15.695
18 HD2 PHE 3 HD2 PHE 3 -1.907 -7.025 14.597
19 HE1 PHE 3 HE1 PHE 3 -1.540 -10.765 17.790
20 HE2 PHE 3 HE2 PHE 3 -3.290 -7.058 16.691
21 HZ PHE 3 HZ PHE 3 -3.090 -8.928 18.263
22 H ASN 4 H ASN 4 -2.410 -7.629 11.930
23 HA ASN 4 HA ASN 4 -1.239 -7.275 9.326
24 1HB ASN 4 1HB ASN 4 -3.724 -7.305 9.578
25 2HB ASN 4 2HB ASN 4 -3.645 -5.947 10.683
26 1HD2 ASN 4 2HD2 ASN 4 -4.088 -4.069 9.845
27 2HD2 ASN 4 1HD2 ASN 4 -3.837 -3.555 8.209
28 H GLY 5 H GLY 5 0.407 -6.560 11.630
29 1HA GLY 5 1HA GLY 5 1.931 -4.756 11.665
30 2HA GLY 5 2HA GLY 5 0.655 -3.662 11.171
31 H GLY 6 H GLY 6 -1.414 -4.691 13.001
32 1HA GLY 6 1HA GLY 6 -1.734 -4.942 15.338
33 2HA GLY 6 2HA GLY 6 -0.244 -4.068 15.635
34 H CYS 7 H CYS 7 -3.325 -3.527 13.764
35 HA CYS 7 HA CYS 7 -3.258 -0.774 14.734
36 1HB CYS 7 1HB CYS 7 -4.699 -2.051 12.406
37 2HB CYS 7 2HB CYS 7 -5.001 -0.411 12.945
38 H LEU 8 H LEU 8 -5.860 -0.010 14.757
39 HA LEU 8 HA LEU 8 -6.945 -1.631 16.891
40 1HB LEU 8 1HB LEU 8 -6.836 0.716 17.260
41 2HB LEU 8 2HB LEU 8 -7.635 1.068 15.741
42 HG LEU 8 HG LEU 8 -9.724 0.077 16.594
43 1HD1 LEU 8 1HD1 LEU 8 -7.961 -0.685 18.861
44 2HD1 LEU 8 2HD1 LEU 8 -9.612 -0.156 19.264
45 3HD1 LEU 8 3HD1 LEU 8 -9.362 -1.525 18.154
46 1HD2 LEU 8 1HD2 LEU 8 -8.408 2.344 18.060
47 2HD2 LEU 8 2HD2 LEU 8 -9.719 2.373 16.857
48 3HD2 LEU 8 3HD2 LEU 8 -10.044 1.808 18.513
49 H ALA 9 H ALA 9 -8.081 -0.283 13.711
50 HA ALA 9 HA ALA 9 -9.072 -2.489 12.596
51 1HB ALA 9 1HB ALA 9 -10.789 -1.652 14.892
52 2HB ALA 9 2HB ALA 9 -11.625 -2.112 13.390
53 3HB ALA 9 3HB ALA 9 -10.528 -3.266 14.187
54 H GLY 10 H GLY 10 -8.637 -1.286 10.741
55 1HA GLY 10 1HA GLY 10 -10.066 -0.174 9.071
56 2HA GLY 10 2HA GLY 10 -10.426 1.030 10.293
57 H TYR 11 H TYR 11 -7.713 1.124 11.465
58 HA TYR 11 HA TYR 11 -6.614 3.098 9.816
59 1HB TYR 11 1HB TYR 11 -5.538 1.293 12.070
60 2HB TYR 11 2HB TYR 11 -4.658 2.690 11.483
61 HD1 TYR 11 HD1 TYR 11 -5.821 4.995 11.657
62 HD2 TYR 11 HD2 TYR 11 -7.147 1.521 13.773
63 HE1 TYR 11 HE1 TYR 11 -7.077 6.469 13.306
64 HE2 TYR 11 HE2 TYR 11 -8.398 3.007 15.414
65 HH TYR 11 HH TYR 11 -9.108 6.158 14.810
66 H MET 12 H MET 12 -4.519 3.130 8.718
67 HA MET 12 HA MET 12 -3.870 0.478 7.682
68 1HB MET 12 1HB MET 12 -2.958 1.956 5.694
69 2HB MET 12 2HB MET 12 -4.692 1.745 5.832
70 1HG MET 12 1HG MET 12 -5.053 3.941 6.537
71 2HG MET 12 2HG MET 12 -3.497 4.059 7.335
72 1HE MET 12 1HE MET 12 -3.793 6.249 6.538
73 2HE MET 12 2HE MET 12 -2.338 6.592 5.571
74 3HE MET 12 3HE MET 12 -3.953 6.789 4.849
75 H ARG 13 H ARG 13 -1.543 0.186 6.988
76 HA ARG 13 HA ARG 13 0.122 1.543 8.928
77 1HB ARG 13 1HB ARG 13 0.359 -0.818 9.148
78 2HB ARG 13 2HB ARG 13 0.328 -1.082 7.416
79 1HG ARG 13 1HG ARG 13 2.560 0.669 8.202
80 2HG ARG 13 2HG ARG 13 2.625 -0.870 9.038
81 1HD ARG 13 1HD ARG 13 1.981 -1.071 6.131
82 2HD ARG 13 2HD ARG 13 3.579 -0.439 6.479
83 HE ARG 13 HE ARG 13 3.311 -2.663 8.161
84 1HH1 ARG 13 1HH1 ARG 13 3.168 -2.089 4.693
85 2HH1 ARG 13 2HH1 ARG 13 3.730 -3.674 4.278
86 1HH2 ARG 13 1HH2 ARG 13 4.052 -4.755 7.615
87 2HH2 ARG 13 2HH2 ARG 13 4.236 -5.200 5.951
88 H THR 14 H THR 14 1.065 3.387 8.075
89 HA THR 14 HA THR 14 1.453 3.796 5.322
90 HB THR 14 HB THR 14 2.732 5.799 6.179
91 HG1 THR 14 HG1 THR 14 2.966 5.827 8.540
92 1HG2 THR 14 1HG2 THR 14 0.161 5.061 7.665
93 2HG2 THR 14 2HG2 THR 14 0.941 6.654 7.812
94 3HG2 THR 14 3HG2 THR 14 0.314 6.112 6.237
95 H ALA 15 H ALA 15 4.090 4.850 5.165
96 HA ALA 15 HA ALA 15 5.475 2.344 4.750
97 1HB ALA 15 1HB ALA 15 5.399 4.081 2.991
98 2HB ALA 15 2HB ALA 15 6.216 5.223 4.084
99 3HB ALA 15 3HB ALA 15 7.069 3.767 3.520
100 H ASP 16 H ASP 16 4.914 4.004 7.456
101 HA ASP 16 HA ASP 16 7.693 3.848 8.323
102 1HB ASP 16 1HB ASP 16 5.951 6.001 8.495
103 2HB ASP 16 2HB ASP 16 5.727 5.253 10.063
104 H GLY 17 H GLY 17 4.508 2.525 8.479
105 1HA GLY 17 1HA GLY 17 3.992 0.533 9.553
106 2HA GLY 17 2HA GLY 17 5.274 0.804 10.718
107 H ARG 18 H ARG 18 3.866 3.798 10.456
108 HA ARG 18 HA ARG 18 2.560 3.475 12.931
109 1HB ARG 18 1HB ARG 18 2.663 5.841 10.992
110 2HB ARG 18 2HB ARG 18 2.001 5.932 12.612
111 1HG ARG 18 1HG ARG 18 4.246 5.156 13.513
112 2HG ARG 18 2HG ARG 18 4.883 5.230 11.882
113 1HD ARG 18 1HD ARG 18 5.468 7.366 12.569
114 2HD ARG 18 2HD ARG 18 3.858 7.724 11.976
115 HE ARG 18 HE ARG 18 3.313 7.051 14.561
116 1HH1 ARG 18 1HH1 ARG 18 5.758 9.178 13.190
117 2HH1 ARG 18 2HH1 ARG 18 5.816 10.215 14.577
118 1HH2 ARG 18 1HH2 ARG 18 3.390 8.418 16.390
119 2HH2 ARG 18 2HH2 ARG 18 4.461 9.779 16.409
120 H CYS 19 H CYS 19 0.503 2.647 13.143
121 HA CYS 19 HA CYS 19 -1.184 2.237 10.980
122 1HB CYS 19 1HB CYS 19 -1.716 2.285 13.953
123 2HB CYS 19 2HB CYS 19 -2.931 1.842 12.770
124 H LYS 20 H LYS 20 -1.753 4.049 9.750
125 HA LYS 20 HA LYS 20 -2.712 6.394 11.199
126 1HB LYS 20 1HB LYS 20 -1.157 5.994 8.837
127 2HB LYS 20 2HB LYS 20 -2.653 6.774 8.363
128 1HG LYS 20 1HG LYS 20 -1.623 8.704 9.025
129 2HG LYS 20 2HG LYS 20 -2.048 8.195 10.646
130 1HD LYS 20 1HD LYS 20 0.135 7.915 11.200
131 2HD LYS 20 2HD LYS 20 0.392 6.837 9.842
132 1HE LYS 20 1HE LYS 20 1.746 8.485 9.024
133 2HE LYS 20 2HE LYS 20 0.258 9.283 8.555
134 1HZ LYS 20 1HZ LYS 20 1.416 9.645 11.220
135 2HZ LYS 20 2HZ LYS 20 1.851 10.584 9.957
136 3HZ LYS 20 3HZ LYS 20 0.301 10.575 10.472
137 HA PRO 21 HA PRO 21 -6.818 5.763 10.009
138 1HB PRO 21 1HB PRO 21 -7.734 8.199 9.177
139 2HB PRO 21 2HB PRO 21 -7.534 7.776 10.866
140 1HG PRO 21 1HG PRO 21 -5.847 9.524 9.180
141 2HG PRO 21 2HG PRO 21 -5.920 9.424 10.928
142 1HD PRO 21 1HD PRO 21 -3.883 8.331 9.232
143 2HD PRO 21 2HD PRO 21 -4.019 8.132 10.966
144 H THR 22 H THR 22 -8.252 5.049 8.446
145 HA THR 22 HA THR 22 -7.101 5.320 5.752
146 HB THR 22 HB THR 22 -9.053 3.219 6.815
147 HG1 THR 22 HG1 THR 22 -6.794 3.539 7.856
148 1HG2 THR 22 1HG2 THR 22 -8.149 3.744 4.209
149 2HG2 THR 22 2HG2 THR 22 -7.010 2.509 4.797
150 3HG2 THR 22 3HG2 THR 22 -8.758 2.176 4.791
151 H PHE 23 H PHE 23 -9.178 6.984 7.562
152 HA PHE 23 HA PHE 23 -11.285 7.040 5.534
153 1HB PHE 23 1HB PHE 23 -12.427 8.394 7.392
154 2HB PHE 23 2HB PHE 23 -12.020 6.759 7.869
155 HD1 PHE 23 HD1 PHE 23 -10.494 10.169 7.899
156 HD2 PHE 23 HD2 PHE 23 -10.987 6.465 9.908
157 HE1 PHE 23 HE1 PHE 23 -9.208 11.062 9.861
158 HE2 PHE 23 HE2 PHE 23 -9.701 7.358 11.870
159 HZ PHE 23 HZ PHE 23 -8.827 9.645 11.823
Start of MODEL 15
1 H GLU 1 H GLU 1 2.288 -7.328 19.312
2 HA GLU 1 HA GLU 1 1.594 -5.878 21.078
3 1HB GLU 1 1HB GLU 1 2.983 -4.828 18.642
4 2HB GLU 1 2HB GLU 1 2.488 -3.633 19.824
5 1HG GLU 1 1HG GLU 1 3.605 -5.171 21.603
6 2HG GLU 1 2HG GLU 1 4.330 -6.020 20.252
7 H ASN 2 H ASN 2 0.619 -4.456 17.867
8 HA ASN 2 HA ASN 2 -1.084 -2.596 18.864
9 1HB ASN 2 1HB ASN 2 -0.379 -3.602 16.320
10 2HB ASN 2 2HB ASN 2 -2.111 -3.858 16.392
11 1HD2 ASN 2 2HD2 ASN 2 0.483 -1.526 16.510
12 2HD2 ASN 2 1HD2 ASN 2 -0.452 -0.096 16.224
13 H PHE 3 H PHE 3 -3.649 -2.709 18.341
14 HA PHE 3 HA PHE 3 -4.898 -4.251 20.119
15 1HB PHE 3 1HB PHE 3 -5.858 -2.435 18.622
16 2HB PHE 3 2HB PHE 3 -5.805 -3.540 17.263
17 HD1 PHE 3 HD1 PHE 3 -7.303 -5.548 17.259
18 HD2 PHE 3 HD2 PHE 3 -7.661 -2.477 20.166
19 HE1 PHE 3 HE1 PHE 3 -9.618 -6.344 17.816
20 HE2 PHE 3 HE2 PHE 3 -9.975 -3.273 20.722
21 HZ PHE 3 HZ PHE 3 -10.926 -5.198 19.542
22 H ASN 4 H ASN 4 -4.907 -5.131 16.586
23 HA ASN 4 HA ASN 4 -5.386 -7.857 17.420
24 1HB ASN 4 1HB ASN 4 -5.780 -8.186 14.899
25 2HB ASN 4 2HB ASN 4 -6.906 -7.104 15.695
26 1HD2 ASN 4 2HD2 ASN 4 -7.343 -5.359 14.606
27 2HD2 ASN 4 1HD2 ASN 4 -6.287 -4.472 13.559
28 H GLY 5 H GLY 5 -2.752 -5.948 17.083
29 1HA GLY 5 1HA GLY 5 -0.593 -6.979 17.134
30 2HA GLY 5 2HA GLY 5 -1.114 -8.097 15.891
31 H GLY 6 H GLY 6 -2.632 -5.725 14.543
32 1HA GLY 6 1HA GLY 6 -0.241 -4.559 13.249
33 2HA GLY 6 2HA GLY 6 -1.729 -4.970 12.419
34 H CYS 7 H CYS 7 -3.794 -3.842 13.254
35 HA CYS 7 HA CYS 7 -3.119 -1.181 14.265
36 1HB CYS 7 1HB CYS 7 -4.678 -1.906 11.812
37 2HB CYS 7 2HB CYS 7 -5.115 -0.470 12.714
38 H LEU 8 H LEU 8 -5.512 -0.085 14.749
39 HA LEU 8 HA LEU 8 -6.607 -1.775 16.765
40 1HB LEU 8 1HB LEU 8 -6.362 0.540 17.218
41 2HB LEU 8 2HB LEU 8 -7.233 0.998 15.770
42 HG LEU 8 HG LEU 8 -9.308 0.012 16.741
43 1HD1 LEU 8 1HD1 LEU 8 -7.522 -1.171 18.563
44 2HD1 LEU 8 2HD1 LEU 8 -8.478 0.000 19.502
45 3HD1 LEU 8 3HD1 LEU 8 -9.300 -1.264 18.555
46 1HD2 LEU 8 1HD2 LEU 8 -7.851 2.313 17.981
47 2HD2 LEU 8 2HD2 LEU 8 -9.315 2.292 16.968
48 3HD2 LEU 8 3HD2 LEU 8 -9.407 1.797 18.675
49 H ALA 9 H ALA 9 -7.912 -0.277 13.722
50 HA ALA 9 HA ALA 9 -9.109 -2.401 12.644
51 1HB ALA 9 1HB ALA 9 -10.607 -1.503 15.071
52 2HB ALA 9 2HB ALA 9 -11.569 -1.900 13.627
53 3HB ALA 9 3HB ALA 9 -10.483 -3.120 14.336
54 H GLY 10 H GLY 10 -8.686 -1.145 10.806
55 1HA GLY 10 1HA GLY 10 -10.142 0.069 9.236
56 2HA GLY 10 2HA GLY 10 -10.411 1.243 10.509
57 H TYR 11 H TYR 11 -7.656 1.227 11.568
58 HA TYR 11 HA TYR 11 -6.560 3.188 9.876
59 1HB TYR 11 1HB TYR 11 -5.444 1.402 12.127
60 2HB TYR 11 2HB TYR 11 -4.612 2.824 11.532
61 HD1 TYR 11 HD1 TYR 11 -7.478 1.609 13.495
62 HD2 TYR 11 HD2 TYR 11 -5.383 5.069 12.102
63 HE1 TYR 11 HE1 TYR 11 -8.738 3.053 15.165
64 HE2 TYR 11 HE2 TYR 11 -6.650 6.502 13.777
65 HH TYR 11 HH TYR 11 -7.821 6.324 15.770
66 H MET 12 H MET 12 -4.528 3.162 8.702
67 HA MET 12 HA MET 12 -3.949 0.482 7.703
68 1HB MET 12 1HB MET 12 -2.971 1.949 5.723
69 2HB MET 12 2HB MET 12 -4.709 1.759 5.844
70 1HG MET 12 1HG MET 12 -4.959 3.938 6.910
71 2HG MET 12 2HG MET 12 -3.228 4.100 7.127
72 1HE MET 12 1HE MET 12 -3.555 6.228 6.411
73 2HE MET 12 2HE MET 12 -2.467 6.377 5.009
74 3HE MET 12 3HE MET 12 -4.186 6.813 4.852
75 H ARG 13 H ARG 13 -1.653 0.050 7.061
76 HA ARG 13 HA ARG 13 0.075 1.348 8.978
77 1HB ARG 13 1HB ARG 13 0.439 -1.189 7.305
78 2HB ARG 13 2HB ARG 13 1.635 -0.586 8.435
79 1HG ARG 13 1HG ARG 13 -0.894 -0.664 9.816
80 2HG ARG 13 2HG ARG 13 -0.703 -2.195 8.985
81 1HD ARG 13 1HD ARG 13 1.847 -1.773 10.048
82 2HD ARG 13 2HD ARG 13 0.807 -1.107 11.292
83 HE ARG 13 HE ARG 13 0.263 -3.296 11.859
84 1HH1 ARG 13 1HH1 ARG 13 1.016 -3.204 8.422
85 2HH1 ARG 13 2HH1 ARG 13 0.764 -4.902 8.191
86 1HH2 ARG 13 1HH2 ARG 13 -0.069 -5.536 11.554
87 2HH2 ARG 13 2HH2 ARG 13 0.143 -6.237 9.985
88 H THR 14 H THR 14 1.027 3.189 8.110
89 HA THR 14 HA THR 14 1.476 3.532 5.349
90 HB THR 14 HB THR 14 2.876 5.508 6.314
91 HG1 THR 14 HG1 THR 14 3.179 4.158 8.350
92 1HG2 THR 14 1HG2 THR 14 -0.027 4.986 7.093
93 2HG2 THR 14 2HG2 THR 14 0.796 6.496 7.549
94 3HG2 THR 14 3HG2 THR 14 0.591 6.078 5.832
95 H ALA 15 H ALA 15 4.054 4.548 5.092
96 HA ALA 15 HA ALA 15 5.496 2.047 4.925
97 1HB ALA 15 1HB ALA 15 5.685 4.802 3.752
98 2HB ALA 15 2HB ALA 15 7.170 3.824 3.834
99 3HB ALA 15 3HB ALA 15 5.751 3.213 2.951
100 H ASP 16 H ASP 16 4.897 3.939 7.459
101 HA ASP 16 HA ASP 16 7.682 3.980 8.317
102 1HB ASP 16 1HB ASP 16 5.311 5.736 8.848
103 2HB ASP 16 2HB ASP 16 6.368 5.452 10.217
104 H GLY 17 H GLY 17 4.464 2.655 8.720
105 1HA GLY 17 1HA GLY 17 4.104 0.663 9.911
106 2HA GLY 17 2HA GLY 17 5.385 1.088 11.030
107 H ARG 18 H ARG 18 3.758 3.961 10.483
108 HA ARG 18 HA ARG 18 2.474 3.737 13.010
109 1HB ARG 18 1HB ARG 18 2.378 6.073 11.039
110 2HB ARG 18 2HB ARG 18 2.048 6.144 12.759
111 1HG ARG 18 1HG ARG 18 4.308 5.957 13.351
112 2HG ARG 18 2HG ARG 18 4.731 5.072 11.899
113 1HD ARG 18 1HD ARG 18 5.547 7.049 11.106
114 2HD ARG 18 2HD ARG 18 3.875 7.514 10.859
115 HE ARG 18 HE ARG 18 4.666 8.006 13.600
116 1HH1 ARG 18 1HH1 ARG 18 4.985 9.287 10.338
117 2HH1 ARG 18 2HH1 ARG 18 5.241 10.917 10.866
118 1HH2 ARG 18 1HH2 ARG 18 5.003 10.156 14.297
119 2HH2 ARG 18 2HH2 ARG 18 5.251 11.414 13.133
120 H CYS 19 H CYS 19 0.445 2.825 13.169
121 HA CYS 19 HA CYS 19 -1.192 2.334 11.005
122 1HB CYS 19 1HB CYS 19 -1.707 2.450 13.968
123 2HB CYS 19 2HB CYS 19 -2.993 2.094 12.833
124 H LYS 20 H LYS 20 -1.688 4.114 9.682
125 HA LYS 20 HA LYS 20 -2.662 6.529 10.972
126 1HB LYS 20 1HB LYS 20 -1.388 5.838 8.418
127 2HB LYS 20 2HB LYS 20 -2.736 6.943 8.238
128 1HG LYS 20 1HG LYS 20 -1.633 8.214 10.286
129 2HG LYS 20 2HG LYS 20 -0.195 7.312 9.851
130 1HD LYS 20 1HD LYS 20 -1.003 8.241 7.374
131 2HD LYS 20 2HD LYS 20 -1.536 9.550 8.410
132 1HE LYS 20 1HE LYS 20 0.594 10.290 8.681
133 2HE LYS 20 2HE LYS 20 1.126 8.714 9.232
134 1HZ LYS 20 1HZ LYS 20 1.148 8.082 6.831
135 2HZ LYS 20 2HZ LYS 20 0.954 9.662 6.465
136 3HZ LYS 20 3HZ LYS 20 2.283 9.170 7.276
137 HA PRO 21 HA PRO 21 -6.810 5.824 9.996
138 1HB PRO 21 1HB PRO 21 -7.759 8.232 9.117
139 2HB PRO 21 2HB PRO 21 -7.491 7.867 10.811
140 1HG PRO 21 1HG PRO 21 -5.874 9.553 8.998
141 2HG PRO 21 2HG PRO 21 -5.877 9.515 10.750
142 1HD PRO 21 1HD PRO 21 -3.909 8.360 9.010
143 2HD PRO 21 2HD PRO 21 -3.975 8.223 10.756
144 H THR 22 H THR 22 -8.299 5.050 8.520
145 HA THR 22 HA THR 22 -7.285 5.275 5.764
146 HB THR 22 HB THR 22 -9.062 3.108 6.995
147 HG1 THR 22 HG1 THR 22 -6.812 3.479 7.926
148 1HG2 THR 22 1HG2 THR 22 -7.442 3.418 4.432
149 2HG2 THR 22 2HG2 THR 22 -7.792 1.807 5.104
150 3HG2 THR 22 3HG2 THR 22 -9.128 2.875 4.612
151 H PHE 23 H PHE 23 -9.341 6.880 7.651
152 HA PHE 23 HA PHE 23 -11.569 6.769 5.763
153 1HB PHE 23 1HB PHE 23 -12.630 8.178 7.639
154 2HB PHE 23 2HB PHE 23 -12.144 6.574 8.147
155 HD1 PHE 23 HD1 PHE 23 -10.720 10.023 7.948
156 HD2 PHE 23 HD2 PHE 23 -10.966 6.384 10.118
157 HE1 PHE 23 HE1 PHE 23 -9.331 11.024 9.784
158 HE2 PHE 23 HE2 PHE 23 -9.578 7.385 11.954
159 HZ PHE 23 HZ PHE 23 -8.776 9.694 11.765
Start of MODEL 16
1 H GLU 1 H GLU 1 -10.383 -14.843 13.018
2 HA GLU 1 HA GLU 1 -9.400 -12.928 11.983
3 1HB GLU 1 1HB GLU 1 -10.587 -13.017 14.540
4 2HB GLU 1 2HB GLU 1 -9.213 -11.948 14.741
5 1HG GLU 1 1HG GLU 1 -10.863 -10.449 14.011
6 2HG GLU 1 2HG GLU 1 -10.049 -10.828 12.506
7 H ASN 2 H ASN 2 -7.493 -11.979 11.366
8 HA ASN 2 HA ASN 2 -5.229 -12.446 13.145
9 1HB ASN 2 1HB ASN 2 -5.302 -12.341 10.084
10 2HB ASN 2 2HB ASN 2 -3.819 -12.400 11.017
11 1HD2 ASN 2 2HD2 ASN 2 -4.000 -14.329 9.325
12 2HD2 ASN 2 1HD2 ASN 2 -4.451 -15.851 10.017
13 H PHE 3 H PHE 3 -3.908 -10.591 13.549
14 HA PHE 3 HA PHE 3 -5.048 -8.087 13.175
15 1HB PHE 3 1HB PHE 3 -2.592 -7.417 13.819
16 2HB PHE 3 2HB PHE 3 -3.447 -8.446 14.951
17 HD1 PHE 3 HD1 PHE 3 -1.362 -8.897 11.875
18 HD2 PHE 3 HD2 PHE 3 -2.218 -10.175 15.830
19 HE1 PHE 3 HE1 PHE 3 0.485 -10.591 11.728
20 HE2 PHE 3 HE2 PHE 3 -0.371 -11.869 15.683
21 HZ PHE 3 HZ PHE 3 0.958 -12.056 13.634
22 H ASN 4 H ASN 4 -4.008 -6.185 12.034
23 HA ASN 4 HA ASN 4 -3.091 -7.105 9.428
24 1HB ASN 4 1HB ASN 4 -5.223 -5.848 9.352
25 2HB ASN 4 2HB ASN 4 -4.522 -4.532 10.272
26 1HD2 ASN 4 2HD2 ASN 4 -3.839 -2.863 9.180
27 2HD2 ASN 4 1HD2 ASN 4 -3.334 -2.823 7.523
28 H GLY 5 H GLY 5 -1.109 -7.037 11.349
29 1HA GLY 5 1HA GLY 5 1.074 -6.154 11.079
30 2HA GLY 5 2HA GLY 5 0.391 -4.595 10.661
31 H GLY 6 H GLY 6 -1.657 -4.504 12.760
32 1HA GLY 6 1HA GLY 6 -1.365 -4.907 15.262
33 2HA GLY 6 2HA GLY 6 0.123 -4.003 15.058
34 H CYS 7 H CYS 7 -3.230 -3.615 13.694
35 HA CYS 7 HA CYS 7 -3.107 -0.845 14.638
36 1HB CYS 7 1HB CYS 7 -4.423 -2.102 12.242
37 2HB CYS 7 2HB CYS 7 -4.986 -0.570 12.879
38 H LEU 8 H LEU 8 -5.653 -0.058 14.815
39 HA LEU 8 HA LEU 8 -6.722 -1.775 16.871
40 1HB LEU 8 1HB LEU 8 -6.584 0.544 17.361
41 2HB LEU 8 2HB LEU 8 -7.392 0.986 15.870
42 HG LEU 8 HG LEU 8 -9.481 -0.065 16.708
43 1HD1 LEU 8 1HD1 LEU 8 -7.915 -1.445 18.440
44 2HD1 LEU 8 2HD1 LEU 8 -8.528 -0.156 19.504
45 3HD1 LEU 8 3HD1 LEU 8 -9.669 -1.211 18.636
46 1HD2 LEU 8 1HD2 LEU 8 -8.152 2.262 17.994
47 2HD2 LEU 8 2HD2 LEU 8 -9.658 2.168 17.049
48 3HD2 LEU 8 3HD2 LEU 8 -9.642 1.656 18.754
49 H ALA 9 H ALA 9 -7.893 -0.282 13.772
50 HA ALA 9 HA ALA 9 -8.948 -2.436 12.604
51 1HB ALA 9 1HB ALA 9 -10.502 -1.757 15.010
52 2HB ALA 9 2HB ALA 9 -11.492 -1.835 13.532
53 3HB ALA 9 3HB ALA 9 -10.514 -3.239 14.023
54 H GLY 10 H GLY 10 -8.646 -1.307 10.711
55 1HA GLY 10 1HA GLY 10 -10.011 -0.080 9.114
56 2HA GLY 10 2HA GLY 10 -10.324 1.107 10.366
57 H TYR 11 H TYR 11 -7.673 1.261 11.525
58 HA TYR 11 HA TYR 11 -6.536 3.210 9.936
59 1HB TYR 11 1HB TYR 11 -5.424 1.247 12.034
60 2HB TYR 11 2HB TYR 11 -4.526 2.652 11.496
61 HD1 TYR 11 HD1 TYR 11 -5.628 4.975 11.839
62 HD2 TYR 11 HD2 TYR 11 -6.946 1.419 13.820
63 HE1 TYR 11 HE1 TYR 11 -6.777 6.382 13.618
64 HE2 TYR 11 HE2 TYR 11 -8.090 2.838 15.592
65 HH TYR 11 HH TYR 11 -7.406 5.815 16.231
66 H MET 12 H MET 12 -4.490 3.268 8.756
67 HA MET 12 HA MET 12 -3.989 0.692 7.482
68 1HB MET 12 1HB MET 12 -2.976 2.328 5.660
69 2HB MET 12 2HB MET 12 -4.719 2.185 5.776
70 1HG MET 12 1HG MET 12 -4.874 4.240 7.100
71 2HG MET 12 2HG MET 12 -3.132 4.332 7.259
72 1HE MET 12 1HE MET 12 -2.455 6.257 6.476
73 2HE MET 12 2HE MET 12 -2.606 6.960 4.848
74 3HE MET 12 3HE MET 12 -3.943 7.118 6.012
75 H ARG 13 H ARG 13 -1.690 0.328 6.716
76 HA ARG 13 HA ARG 13 0.074 1.311 8.785
77 1HB ARG 13 1HB ARG 13 -0.247 -1.206 7.363
78 2HB ARG 13 2HB ARG 13 1.387 -0.626 7.114
79 1HG ARG 13 1HG ARG 13 0.879 -0.154 9.860
80 2HG ARG 13 2HG ARG 13 0.159 -1.720 9.544
81 1HD ARG 13 1HD ARG 13 2.227 -2.670 8.822
82 2HD ARG 13 2HD ARG 13 2.955 -1.103 8.529
83 HE ARG 13 HE ARG 13 2.501 -0.942 11.204
84 1HH1 ARG 13 1HH1 ARG 13 3.881 -3.536 9.268
85 2HH1 ARG 13 2HH1 ARG 13 4.884 -4.131 10.548
86 1HH2 ARG 13 1HH2 ARG 13 3.824 -1.726 12.894
87 2HH2 ARG 13 2HH2 ARG 13 4.852 -3.094 12.625
88 H THR 14 H THR 14 1.123 3.198 8.192
89 HA THR 14 HA THR 14 1.527 3.948 5.504
90 HB THR 14 HB THR 14 2.903 5.762 6.630
91 HG1 THR 14 HG1 THR 14 3.169 5.477 8.923
92 1HG2 THR 14 1HG2 THR 14 0.262 5.702 6.667
93 2HG2 THR 14 2HG2 THR 14 0.466 5.226 8.371
94 3HG2 THR 14 3HG2 THR 14 1.099 6.788 7.802
95 H ALA 15 H ALA 15 4.182 4.902 5.437
96 HA ALA 15 HA ALA 15 5.480 2.424 4.728
97 1HB ALA 15 1HB ALA 15 5.399 4.971 3.659
98 2HB ALA 15 2HB ALA 15 6.982 4.952 4.474
99 3HB ALA 15 3HB ALA 15 6.598 3.722 3.246
100 H ASP 16 H ASP 16 5.023 3.990 7.599
101 HA ASP 16 HA ASP 16 7.734 3.362 8.470
102 1HB ASP 16 1HB ASP 16 5.985 5.652 8.945
103 2HB ASP 16 2HB ASP 16 6.387 4.889 10.471
104 H GLY 17 H GLY 17 4.441 2.452 8.469
105 1HA GLY 17 1HA GLY 17 3.645 0.513 9.474
106 2HA GLY 17 2HA GLY 17 4.864 0.637 10.727
107 H ARG 18 H ARG 18 3.909 3.763 10.522
108 HA ARG 18 HA ARG 18 2.505 3.673 12.891
109 1HB ARG 18 1HB ARG 18 2.529 5.880 10.769
110 2HB ARG 18 2HB ARG 18 2.038 6.096 12.437
111 1HG ARG 18 1HG ARG 18 4.795 5.023 11.713
112 2HG ARG 18 2HG ARG 18 4.477 6.743 11.810
113 1HD ARG 18 1HD ARG 18 3.586 6.355 14.182
114 2HD ARG 18 2HD ARG 18 4.154 4.702 14.059
115 HE ARG 18 HE ARG 18 6.338 5.463 14.385
116 1HH1 ARG 18 1HH1 ARG 18 4.340 8.162 13.334
117 2HH1 ARG 18 2HH1 ARG 18 5.591 9.340 13.557
118 1HH2 ARG 18 1HH2 ARG 18 7.988 7.016 14.680
119 2HH2 ARG 18 2HH2 ARG 18 7.679 8.684 14.328
120 H CYS 19 H CYS 19 0.462 2.827 13.176
121 HA CYS 19 HA CYS 19 -1.289 2.348 11.075
122 1HB CYS 19 1HB CYS 19 -1.737 2.498 14.058
123 2HB CYS 19 2HB CYS 19 -2.982 2.015 12.924
124 H LYS 20 H LYS 20 -1.900 4.114 9.805
125 HA LYS 20 HA LYS 20 -2.840 6.495 11.221
126 1HB LYS 20 1HB LYS 20 -1.289 6.054 8.841
127 2HB LYS 20 2HB LYS 20 -2.761 6.898 8.406
128 1HG LYS 20 1HG LYS 20 -1.555 8.750 9.048
129 2HG LYS 20 2HG LYS 20 -2.130 8.307 10.643
130 1HD LYS 20 1HD LYS 20 0.181 6.710 10.235
131 2HD LYS 20 2HD LYS 20 0.605 8.285 9.594
132 1HE LYS 20 1HE LYS 20 -0.750 8.049 12.304
133 2HE LYS 20 2HE LYS 20 0.979 7.809 12.157
134 1HZ LYS 20 1HZ LYS 20 0.409 10.078 10.738
135 2HZ LYS 20 2HZ LYS 20 -0.459 10.211 12.115
136 3HZ LYS 20 3HZ LYS 20 1.157 9.988 12.187
137 HA PRO 21 HA PRO 21 -6.924 5.877 9.944
138 1HB PRO 21 1HB PRO 21 -7.794 8.265 8.941
139 2HB PRO 21 2HB PRO 21 -7.635 7.947 10.657
140 1HG PRO 21 1HG PRO 21 -5.893 9.568 8.904
141 2HG PRO 21 2HG PRO 21 -6.006 9.580 10.653
142 1HD PRO 21 1HD PRO 21 -3.944 8.361 9.074
143 2HD PRO 21 2HD PRO 21 -4.121 8.274 10.816
144 H THR 22 H THR 22 -8.311 5.054 8.403
145 HA THR 22 HA THR 22 -7.169 5.270 5.695
146 HB THR 22 HB THR 22 -8.832 3.004 6.907
147 HG1 THR 22 HG1 THR 22 -6.789 3.141 7.981
148 1HG2 THR 22 1HG2 THR 22 -7.136 3.339 4.387
149 2HG2 THR 22 2HG2 THR 22 -7.544 1.739 5.052
150 3HG2 THR 22 3HG2 THR 22 -8.837 2.825 4.491
151 H PHE 23 H PHE 23 -9.394 6.760 7.476
152 HA PHE 23 HA PHE 23 -11.495 6.525 5.450
153 1HB PHE 23 1HB PHE 23 -12.790 7.765 7.320
154 2HB PHE 23 2HB PHE 23 -12.262 6.148 7.743
155 HD1 PHE 23 HD1 PHE 23 -11.121 9.693 7.975
156 HD2 PHE 23 HD2 PHE 23 -11.122 5.831 9.732
157 HE1 PHE 23 HE1 PHE 23 -9.935 10.609 9.988
158 HE2 PHE 23 HE2 PHE 23 -9.935 6.747 11.745
159 HZ PHE 23 HZ PHE 23 -9.356 9.125 11.849
Start of MODEL 17
1 H GLU 1 H GLU 1 -5.293 -10.665 0.973
2 HA GLU 1 HA GLU 1 -5.613 -10.767 3.338
3 1HB GLU 1 1HB GLU 1 -3.556 -11.855 2.026
4 2HB GLU 1 2HB GLU 1 -2.614 -10.749 3.006
5 1HG GLU 1 1HG GLU 1 -3.227 -11.786 5.026
6 2HG GLU 1 2HG GLU 1 -4.729 -12.411 4.376
7 H ASN 2 H ASN 2 -6.288 -8.305 3.515
8 HA ASN 2 HA ASN 2 -4.599 -6.307 4.037
9 1HB ASN 2 1HB ASN 2 -6.393 -5.402 5.578
10 2HB ASN 2 2HB ASN 2 -7.035 -5.997 4.061
11 1HD2 ASN 2 2HD2 ASN 2 -7.784 -5.810 7.115
12 2HD2 ASN 2 1HD2 ASN 2 -8.603 -7.305 7.421
13 H PHE 3 H PHE 3 -4.254 -5.278 6.406
14 HA PHE 3 HA PHE 3 -3.225 -7.443 8.097
15 1HB PHE 3 1HB PHE 3 -2.284 -4.808 7.106
16 2HB PHE 3 2HB PHE 3 -2.171 -4.898 8.852
17 HD1 PHE 3 HD1 PHE 3 -1.074 -6.511 5.713
18 HD2 PHE 3 HD2 PHE 3 -0.480 -6.185 9.902
19 HE1 PHE 3 HE1 PHE 3 1.076 -7.790 5.508
20 HE2 PHE 3 HE2 PHE 3 1.670 -7.463 9.697
21 HZ PHE 3 HZ PHE 3 2.422 -8.250 7.502
22 H ASN 4 H ASN 4 -3.141 -6.857 10.508
23 HA ASN 4 HA ASN 4 -4.658 -4.863 11.579
24 1HB ASN 4 1HB ASN 4 -6.389 -6.684 10.368
25 2HB ASN 4 2HB ASN 4 -6.336 -7.291 12.011
26 1HD2 ASN 4 2HD2 ASN 4 -6.371 -5.443 13.710
27 2HD2 ASN 4 1HD2 ASN 4 -7.616 -4.256 13.511
28 H GLY 5 H GLY 5 -2.204 -6.278 12.049
29 1HA GLY 5 1HA GLY 5 -2.772 -7.817 14.509
30 2HA GLY 5 2HA GLY 5 -1.374 -8.036 13.475
31 H GLY 6 H GLY 6 -2.832 -4.889 14.464
32 1HA GLY 6 1HA GLY 6 -1.094 -4.346 16.603
33 2HA GLY 6 2HA GLY 6 -0.371 -3.729 15.131
34 H CYS 7 H CYS 7 -2.877 -3.129 13.717
35 HA CYS 7 HA CYS 7 -3.322 -0.569 14.831
36 1HB CYS 7 1HB CYS 7 -4.781 -1.997 12.598
37 2HB CYS 7 2HB CYS 7 -4.929 -0.296 12.989
38 H LEU 8 H LEU 8 -5.995 -0.006 14.721
39 HA LEU 8 HA LEU 8 -7.032 -1.661 16.879
40 1HB LEU 8 1HB LEU 8 -6.963 0.662 17.348
41 2HB LEU 8 2HB LEU 8 -7.719 1.075 15.821
42 HG LEU 8 HG LEU 8 -9.822 0.009 16.584
43 1HD1 LEU 8 1HD1 LEU 8 -8.265 -1.312 18.413
44 2HD1 LEU 8 2HD1 LEU 8 -9.059 -0.075 19.417
45 3HD1 LEU 8 3HD1 LEU 8 -10.042 -1.202 18.452
46 1HD2 LEU 8 1HD2 LEU 8 -8.583 2.304 18.058
47 2HD2 LEU 8 2HD2 LEU 8 -9.917 2.286 16.879
48 3HD2 LEU 8 3HD2 LEU 8 -10.192 1.715 18.543
49 H ALA 9 H ALA 9 -8.116 -0.236 13.717
50 HA ALA 9 HA ALA 9 -9.090 -2.428 12.547
51 1HB ALA 9 1HB ALA 9 -10.912 -1.538 14.762
52 2HB ALA 9 2HB ALA 9 -11.645 -2.108 13.243
53 3HB ALA 9 3HB ALA 9 -10.561 -3.178 14.166
54 H GLY 10 H GLY 10 -8.804 -1.376 10.621
55 1HA GLY 10 1HA GLY 10 -10.119 -0.184 8.970
56 2HA GLY 10 2HA GLY 10 -10.474 1.027 10.186
57 H TYR 11 H TYR 11 -7.789 1.117 11.391
58 HA TYR 11 HA TYR 11 -6.639 3.044 9.711
59 1HB TYR 11 1HB TYR 11 -5.634 1.313 12.053
60 2HB TYR 11 2HB TYR 11 -4.739 2.693 11.449
61 HD1 TYR 11 HD1 TYR 11 -7.760 1.627 13.277
62 HD2 TYR 11 HD2 TYR 11 -5.441 4.966 11.942
63 HE1 TYR 11 HE1 TYR 11 -9.058 3.161 14.834
64 HE2 TYR 11 HE2 TYR 11 -6.747 6.488 13.504
65 HH TYR 11 HH TYR 11 -9.558 5.870 14.687
66 H MET 12 H MET 12 -4.514 3.028 8.674
67 HA MET 12 HA MET 12 -3.813 0.334 7.793
68 1HB MET 12 1HB MET 12 -2.936 1.677 5.708
69 2HB MET 12 2HB MET 12 -4.668 1.460 5.862
70 1HG MET 12 1HG MET 12 -4.885 3.716 6.890
71 2HG MET 12 2HG MET 12 -3.147 3.933 6.823
72 1HE MET 12 1HE MET 12 -2.691 5.818 5.361
73 2HE MET 12 2HE MET 12 -3.654 6.281 3.938
74 3HE MET 12 3HE MET 12 -4.407 6.247 5.551
75 H ARG 13 H ARG 13 -1.464 0.108 7.074
76 HA ARG 13 HA ARG 13 0.143 1.585 8.972
77 1HB ARG 13 1HB ARG 13 0.028 -1.128 8.355
78 2HB ARG 13 2HB ARG 13 1.423 -0.616 7.427
79 1HG ARG 13 1HG ARG 13 2.438 -1.093 9.473
80 2HG ARG 13 2HG ARG 13 2.125 0.619 9.672
81 1HD ARG 13 1HD ARG 13 1.109 -0.037 11.625
82 2HD ARG 13 2HD ARG 13 -0.255 -0.395 10.585
83 HE ARG 13 HE ARG 13 0.053 -2.633 11.136
84 1HH1 ARG 13 1HH1 ARG 13 3.183 -1.029 11.255
85 2HH1 ARG 13 2HH1 ARG 13 4.041 -2.458 11.727
86 1HH2 ARG 13 1HH2 ARG 13 1.184 -4.518 11.758
87 2HH2 ARG 13 2HH2 ARG 13 2.895 -4.456 12.015
88 H THR 14 H THR 14 0.985 3.454 8.071
89 HA THR 14 HA THR 14 1.326 3.875 5.337
90 HB THR 14 HB THR 14 2.438 5.921 6.091
91 HG1 THR 14 HG1 THR 14 3.718 5.703 7.887
92 1HG2 THR 14 1HG2 THR 14 0.001 4.991 7.356
93 2HG2 THR 14 2HG2 THR 14 0.967 5.868 8.567
94 3HG2 THR 14 3HG2 THR 14 0.505 6.670 7.047
95 H ALA 15 H ALA 15 4.023 4.970 5.261
96 HA ALA 15 HA ALA 15 5.372 2.455 4.706
97 1HB ALA 15 1HB ALA 15 5.184 4.985 3.448
98 2HB ALA 15 2HB ALA 15 6.861 4.850 4.028
99 3HB ALA 15 3HB ALA 15 6.187 3.600 2.953
100 H ASP 16 H ASP 16 4.888 4.076 7.442
101 HA ASP 16 HA ASP 16 7.698 3.987 8.209
102 1HB ASP 16 1HB ASP 16 5.520 5.861 8.757
103 2HB ASP 16 2HB ASP 16 6.155 5.225 10.262
104 H GLY 17 H GLY 17 4.510 2.614 8.522
105 1HA GLY 17 1HA GLY 17 4.157 0.525 9.521
106 2HA GLY 17 2HA GLY 17 5.458 0.832 10.654
107 H ARG 18 H ARG 18 3.775 3.734 10.389
108 HA ARG 18 HA ARG 18 2.563 3.269 12.923
109 1HB ARG 18 1HB ARG 18 2.247 5.650 13.003
110 2HB ARG 18 2HB ARG 18 3.779 5.422 12.184
111 1HG ARG 18 1HG ARG 18 2.306 5.434 9.979
112 2HG ARG 18 2HG ARG 18 1.100 6.199 10.995
113 1HD ARG 18 1HD ARG 18 3.935 7.271 11.013
114 2HD ARG 18 2HD ARG 18 2.877 7.680 9.677
115 HE ARG 18 HE ARG 18 1.517 8.961 11.138
116 1HH1 ARG 18 1HH1 ARG 18 3.966 7.191 12.942
117 2HH1 ARG 18 2HH1 ARG 18 3.705 8.074 14.409
118 1HH2 ARG 18 1HH2 ARG 18 1.173 10.125 13.073
119 2HH2 ARG 18 2HH2 ARG 18 2.106 9.754 14.485
120 H CYS 19 H CYS 19 0.468 2.559 13.178
121 HA CYS 19 HA CYS 19 -1.200 2.145 10.982
122 1HB CYS 19 1HB CYS 19 -1.776 2.159 13.948
123 2HB CYS 19 2HB CYS 19 -2.946 1.685 12.733
124 H LYS 20 H LYS 20 -1.704 4.013 9.789
125 HA LYS 20 HA LYS 20 -2.694 6.315 11.280
126 1HB LYS 20 1HB LYS 20 -1.176 5.931 8.854
127 2HB LYS 20 2HB LYS 20 -2.627 6.848 8.501
128 1HG LYS 20 1HG LYS 20 -2.086 8.399 10.411
129 2HG LYS 20 2HG LYS 20 -0.610 7.500 10.702
130 1HD LYS 20 1HD LYS 20 0.482 8.564 9.014
131 2HD LYS 20 2HD LYS 20 -0.811 8.236 7.877
132 1HE LYS 20 1HE LYS 20 -1.307 10.354 9.963
133 2HE LYS 20 2HE LYS 20 -0.197 10.746 8.665
134 1HZ LYS 20 1HZ LYS 20 -2.064 9.805 7.202
135 2HZ LYS 20 2HZ LYS 20 -3.025 10.082 8.493
136 3HZ LYS 20 3HZ LYS 20 -2.212 11.317 7.800
137 HA PRO 21 HA PRO 21 -6.787 5.728 10.023
138 1HB PRO 21 1HB PRO 21 -7.681 8.183 9.221
139 2HB PRO 21 2HB PRO 21 -7.504 7.731 10.905
140 1HG PRO 21 1HG PRO 21 -5.788 9.498 9.269
141 2HG PRO 21 2HG PRO 21 -5.884 9.369 11.014
142 1HD PRO 21 1HD PRO 21 -3.830 8.295 9.325
143 2HD PRO 21 2HD PRO 21 -3.989 8.069 11.055
144 H THR 22 H THR 22 -8.202 5.045 8.431
145 HA THR 22 HA THR 22 -7.010 5.341 5.759
146 HB THR 22 HB THR 22 -9.049 3.272 6.703
147 HG1 THR 22 HG1 THR 22 -6.892 2.040 6.908
148 1HG2 THR 22 1HG2 THR 22 -7.094 3.569 4.396
149 2HG2 THR 22 2HG2 THR 22 -7.526 1.945 4.984
150 3HG2 THR 22 3HG2 THR 22 -8.789 3.030 4.354
151 H PHE 23 H PHE 23 -9.091 7.015 7.560
152 HA PHE 23 HA PHE 23 -11.131 7.165 5.466
153 1HB PHE 23 1HB PHE 23 -12.357 8.418 7.332
154 2HB PHE 23 2HB PHE 23 -11.949 6.771 7.767
155 HD1 PHE 23 HD1 PHE 23 -10.638 10.248 8.057
156 HD2 PHE 23 HD2 PHE 23 -10.824 6.363 9.755
157 HE1 PHE 23 HE1 PHE 23 -9.443 11.082 10.101
158 HE2 PHE 23 HE2 PHE 23 -9.629 7.198 11.799
159 HZ PHE 23 HZ PHE 23 -8.953 9.548 11.946
Start of MODEL 18
1 H GLU 1 H GLU 1 -9.035 -13.618 16.835
2 HA GLU 1 HA GLU 1 -10.636 -12.400 15.547
3 1HB GLU 1 1HB GLU 1 -8.947 -11.069 17.626
4 2HB GLU 1 2HB GLU 1 -10.015 -10.016 16.720
5 1HG GLU 1 1HG GLU 1 -11.971 -11.353 17.332
6 2HG GLU 1 2HG GLU 1 -10.963 -12.594 18.050
7 H ASN 2 H ASN 2 -7.424 -10.681 15.580
8 HA ASN 2 HA ASN 2 -7.291 -10.443 12.849
9 1HB ASN 2 1HB ASN 2 -9.290 -8.890 13.235
10 2HB ASN 2 2HB ASN 2 -8.244 -7.858 14.190
11 1HD2 ASN 2 2HD2 ASN 2 -7.770 -6.122 13.089
12 2HD2 ASN 2 1HD2 ASN 2 -7.271 -6.030 11.432
13 H PHE 3 H PHE 3 -5.328 -9.158 12.247
14 HA PHE 3 HA PHE 3 -3.938 -7.597 14.099
15 1HB PHE 3 1HB PHE 3 -3.809 -10.130 14.941
16 2HB PHE 3 2HB PHE 3 -2.711 -10.356 13.594
17 HD1 PHE 3 HD1 PHE 3 -0.508 -9.298 13.592
18 HD2 PHE 3 HD2 PHE 3 -3.148 -8.841 16.882
19 HE1 PHE 3 HE1 PHE 3 1.395 -8.472 15.004
20 HE2 PHE 3 HE2 PHE 3 -1.245 -8.014 18.294
21 HZ PHE 3 HZ PHE 3 1.004 -7.839 17.339
22 H ASN 4 H ASN 4 -3.899 -6.350 12.104
23 HA ASN 4 HA ASN 4 -2.182 -7.510 10.067
24 1HB ASN 4 1HB ASN 4 -3.025 -5.366 8.781
25 2HB ASN 4 2HB ASN 4 -4.139 -6.701 8.997
26 1HD2 ASN 4 2HD2 ASN 4 -3.435 -3.433 9.649
27 2HD2 ASN 4 1HD2 ASN 4 -4.808 -3.034 10.628
28 H GLY 5 H GLY 5 -0.605 -6.906 12.131
29 1HA GLY 5 1HA GLY 5 1.434 -5.646 12.016
30 2HA GLY 5 2HA GLY 5 0.514 -4.242 11.509
31 H GLY 6 H GLY 6 -1.714 -4.464 13.346
32 1HA GLY 6 1HA GLY 6 -1.809 -4.793 15.822
33 2HA GLY 6 2HA GLY 6 -0.316 -3.877 15.885
34 H CYS 7 H CYS 7 -3.376 -3.463 13.962
35 HA CYS 7 HA CYS 7 -3.372 -0.681 14.832
36 1HB CYS 7 1HB CYS 7 -4.799 -2.058 12.549
37 2HB CYS 7 2HB CYS 7 -5.030 -0.377 12.984
38 H LEU 8 H LEU 8 -5.918 0.115 14.858
39 HA LEU 8 HA LEU 8 -7.060 -1.418 17.008
40 1HB LEU 8 1HB LEU 8 -6.989 0.942 17.254
41 2HB LEU 8 2HB LEU 8 -7.741 1.206 15.693
42 HG LEU 8 HG LEU 8 -9.846 0.218 16.545
43 1HD1 LEU 8 1HD1 LEU 8 -8.272 -0.902 18.513
44 2HD1 LEU 8 2HD1 LEU 8 -9.133 0.394 19.378
45 3HD1 LEU 8 3HD1 LEU 8 -10.051 -0.849 18.495
46 1HD2 LEU 8 1HD2 LEU 8 -8.838 2.742 16.974
47 2HD2 LEU 8 2HD2 LEU 8 -10.529 2.237 17.214
48 3HD2 LEU 8 3HD2 LEU 8 -9.404 2.265 18.594
49 H ALA 9 H ALA 9 -8.126 -0.284 13.723
50 HA ALA 9 HA ALA 9 -9.085 -2.570 12.742
51 1HB ALA 9 1HB ALA 9 -10.760 -1.687 15.000
52 2HB ALA 9 2HB ALA 9 -11.677 -1.963 13.500
53 3HB ALA 9 3HB ALA 9 -10.681 -3.268 14.186
54 H GLY 10 H GLY 10 -8.619 -1.532 10.803
55 1HA GLY 10 1HA GLY 10 -9.964 -0.539 9.013
56 2HA GLY 10 2HA GLY 10 -10.390 0.742 10.131
57 H TYR 11 H TYR 11 -7.855 1.163 11.414
58 HA TYR 11 HA TYR 11 -6.684 2.982 9.716
59 1HB TYR 11 1HB TYR 11 -5.632 1.267 12.050
60 2HB TYR 11 2HB TYR 11 -4.747 2.647 11.430
61 HD1 TYR 11 HD1 TYR 11 -7.727 1.574 13.312
62 HD2 TYR 11 HD2 TYR 11 -5.474 4.924 11.896
63 HE1 TYR 11 HE1 TYR 11 -9.018 3.112 14.873
64 HE2 TYR 11 HE2 TYR 11 -6.771 6.450 13.463
65 HH TYR 11 HH TYR 11 -9.545 5.828 14.692
66 H MET 12 H MET 12 -4.547 3.017 8.683
67 HA MET 12 HA MET 12 -3.823 0.346 7.750
68 1HB MET 12 1HB MET 12 -2.953 1.728 5.695
69 2HB MET 12 2HB MET 12 -4.687 1.528 5.849
70 1HG MET 12 1HG MET 12 -4.881 3.762 6.918
71 2HG MET 12 2HG MET 12 -3.141 3.960 6.870
72 1HE MET 12 1HE MET 12 -3.141 5.955 5.911
73 2HE MET 12 2HE MET 12 -3.175 6.275 4.160
74 3HE MET 12 3HE MET 12 -4.666 6.424 5.121
75 H ARG 13 H ARG 13 -1.471 0.144 7.038
76 HA ARG 13 HA ARG 13 0.124 1.600 8.965
77 1HB ARG 13 1HB ARG 13 0.017 -1.074 8.525
78 2HB ARG 13 2HB ARG 13 1.250 -0.681 7.343
79 1HG ARG 13 1HG ARG 13 2.715 -0.830 9.087
80 2HG ARG 13 2HG ARG 13 2.137 0.764 9.528
81 1HD ARG 13 1HD ARG 13 1.350 -0.086 11.479
82 2HD ARG 13 2HD ARG 13 0.213 -1.066 10.575
83 HE ARG 13 HE ARG 13 2.454 -2.583 10.347
84 1HH1 ARG 13 1HH1 ARG 13 1.058 -0.978 13.150
85 2HH1 ARG 13 2HH1 ARG 13 1.672 -2.138 14.280
86 1HH2 ARG 13 1HH2 ARG 13 3.265 -4.114 11.837
87 2HH2 ARG 13 2HH2 ARG 13 2.936 -3.934 13.528
88 H THR 14 H THR 14 0.978 3.474 8.081
89 HA THR 14 HA THR 14 1.326 3.913 5.351
90 HB THR 14 HB THR 14 2.446 5.949 6.125
91 HG1 THR 14 HG1 THR 14 3.773 5.647 7.867
92 1HG2 THR 14 1HG2 THR 14 -0.061 5.352 6.998
93 2HG2 THR 14 2HG2 THR 14 0.773 5.412 8.569
94 3HG2 THR 14 3HG2 THR 14 0.784 6.835 7.500
95 H ALA 15 H ALA 15 4.014 4.991 5.249
96 HA ALA 15 HA ALA 15 5.357 2.476 4.691
97 1HB ALA 15 1HB ALA 15 5.109 4.834 3.303
98 2HB ALA 15 2HB ALA 15 6.698 5.044 4.075
99 3HB ALA 15 3HB ALA 15 6.394 3.632 3.034
100 H ASP 16 H ASP 16 4.884 4.074 7.438
101 HA ASP 16 HA ASP 16 7.696 3.969 8.199
102 1HB ASP 16 1HB ASP 16 5.902 6.050 8.512
103 2HB ASP 16 2HB ASP 16 5.722 5.229 10.050
104 H GLY 17 H GLY 17 4.508 2.601 8.497
105 1HA GLY 17 1HA GLY 17 4.126 0.522 9.491
106 2HA GLY 17 2HA GLY 17 5.446 0.795 10.610
107 H ARG 18 H ARG 18 3.743 3.709 10.347
108 HA ARG 18 HA ARG 18 2.569 3.237 12.907
109 1HB ARG 18 1HB ARG 18 2.284 5.623 13.017
110 2HB ARG 18 2HB ARG 18 3.814 5.378 12.200
111 1HG ARG 18 1HG ARG 18 2.313 5.426 9.997
112 2HG ARG 18 2HG ARG 18 1.162 6.249 11.031
113 1HD ARG 18 1HD ARG 18 4.072 7.134 10.738
114 2HD ARG 18 2HD ARG 18 2.770 7.781 9.758
115 HE ARG 18 HE ARG 18 1.832 8.093 12.351
116 1HH1 ARG 18 1HH1 ARG 18 4.769 9.064 10.674
117 2HH1 ARG 18 2HH1 ARG 18 5.012 10.475 11.649
118 1HH2 ARG 18 2HH2 ARG 18 2.152 9.954 13.637
119 2HH2 ARG 18 1HH2 ARG 18 3.513 10.984 13.346
120 H CYS 19 H CYS 19 0.465 2.555 13.166
121 HA CYS 19 HA CYS 19 -1.219 2.176 10.985
122 1HB CYS 19 1HB CYS 19 -1.797 2.228 13.952
123 2HB CYS 19 2HB CYS 19 -2.969 1.756 12.737
124 H LYS 20 H LYS 20 -1.776 3.996 9.773
125 HA LYS 20 HA LYS 20 -2.698 6.343 11.251
126 1HB LYS 20 1HB LYS 20 -1.187 5.921 8.817
127 2HB LYS 20 2HB LYS 20 -2.610 6.888 8.485
128 1HG LYS 20 1HG LYS 20 -1.960 8.291 10.569
129 2HG LYS 20 2HG LYS 20 -0.421 7.453 10.528
130 1HD LYS 20 1HD LYS 20 0.321 8.651 8.728
131 2HD LYS 20 2HD LYS 20 -1.200 8.487 7.874
132 1HE LYS 20 1HE LYS 20 -1.850 10.204 9.997
133 2HE LYS 20 2HE LYS 20 -0.230 10.710 9.563
134 1HZ LYS 20 1HZ LYS 20 -2.362 10.342 7.581
135 2HZ LYS 20 2HZ LYS 20 -2.043 11.776 8.295
136 3HZ LYS 20 3HZ LYS 20 -0.914 11.063 7.355
137 HA PRO 21 HA PRO 21 -6.791 5.789 9.985
138 1HB PRO 21 1HB PRO 21 -7.666 8.267 9.238
139 2HB PRO 21 2HB PRO 21 -7.496 7.775 10.911
140 1HG PRO 21 1HG PRO 21 -5.763 9.568 9.322
141 2HG PRO 21 2HG PRO 21 -5.865 9.400 11.063
142 1HD PRO 21 1HD PRO 21 -3.814 8.350 9.354
143 2HD PRO 21 2HD PRO 21 -3.980 8.085 11.080
144 H THR 22 H THR 22 -8.191 5.132 8.376
145 HA THR 22 HA THR 22 -6.921 5.243 5.757
146 HB THR 22 HB THR 22 -9.463 3.768 6.584
147 HG1 THR 22 HG1 THR 22 -6.666 2.907 6.703
148 1HG2 THR 22 1HG2 THR 22 -7.202 3.238 4.586
149 2HG2 THR 22 2HG2 THR 22 -8.471 2.058 4.990
150 3HG2 THR 22 3HG2 THR 22 -8.902 3.588 4.191
151 H PHE 23 H PHE 23 -8.636 7.433 7.385
152 HA PHE 23 HA PHE 23 -10.363 8.042 5.091
153 1HB PHE 23 1HB PHE 23 -11.552 9.463 6.856
154 2HB PHE 23 2HB PHE 23 -11.559 7.752 7.237
155 HD1 PHE 23 HD1 PHE 23 -9.531 10.818 7.883
156 HD2 PHE 23 HD2 PHE 23 -10.916 7.087 9.355
157 HE1 PHE 23 HE1 PHE 23 -8.488 11.311 10.113
158 HE2 PHE 23 HE2 PHE 23 -9.874 7.580 11.585
159 HZ PHE 23 HZ PHE 23 -8.673 9.686 11.937
Start of MODEL 19
1 H GLU 1 H GLU 1 0.081 -10.593 15.771
2 HA GLU 1 HA GLU 1 -2.305 -10.702 15.764
3 1HB GLU 1 1HB GLU 1 -0.966 -9.222 17.423
4 2HB GLU 1 2HB GLU 1 -1.511 -7.854 16.472
5 1HG GLU 1 1HG GLU 1 -3.915 -8.940 16.782
6 2HG GLU 1 2HG GLU 1 -3.163 -9.789 18.119
7 H ASN 2 H ASN 2 -3.786 -10.705 14.126
8 HA ASN 2 HA ASN 2 -5.195 -9.919 12.662
9 1HB ASN 2 1HB ASN 2 -3.981 -7.124 12.872
10 2HB ASN 2 2HB ASN 2 -5.607 -7.542 12.369
11 1HD2 ASN 2 2HD2 ASN 2 -7.035 -8.539 13.937
12 2HD2 ASN 2 1HD2 ASN 2 -6.916 -8.117 15.613
13 H PHE 3 H PHE 3 -5.185 -9.344 10.298
14 HA PHE 3 HA PHE 3 -2.533 -9.698 9.190
15 1HB PHE 3 1HB PHE 3 -5.121 -10.620 8.641
16 2HB PHE 3 2HB PHE 3 -4.970 -9.324 7.470
17 HD1 PHE 3 HD1 PHE 3 -3.135 -12.330 8.696
18 HD2 PHE 3 HD2 PHE 3 -3.973 -9.761 5.424
19 HE1 PHE 3 HE1 PHE 3 -1.861 -13.861 7.167
20 HE2 PHE 3 HE2 PHE 3 -2.699 -11.292 3.896
21 HZ PHE 3 HZ PHE 3 -1.659 -13.323 4.786
22 H ASN 4 H ASN 4 -3.253 -7.098 10.469
23 HA ASN 4 HA ASN 4 -3.173 -5.447 8.067
24 1HB ASN 4 1HB ASN 4 -5.131 -4.844 9.356
25 2HB ASN 4 2HB ASN 4 -4.254 -4.918 10.871
26 1HD2 ASN 4 2HD2 ASN 4 -5.049 -3.061 8.084
27 2HD2 ASN 4 1HD2 ASN 4 -4.295 -1.567 8.529
28 H GLY 5 H GLY 5 -1.315 -6.842 10.481
29 1HA GLY 5 1HA GLY 5 0.993 -6.399 10.639
30 2HA GLY 5 2HA GLY 5 0.696 -4.700 10.331
31 H GLY 6 H GLY 6 -1.604 -4.416 12.153
32 1HA GLY 6 1HA GLY 6 -1.686 -5.151 14.625
33 2HA GLY 6 2HA GLY 6 -0.102 -4.406 14.683
34 H CYS 7 H CYS 7 -3.528 -3.749 13.704
35 HA CYS 7 HA CYS 7 -3.079 -0.996 14.601
36 1HB CYS 7 1HB CYS 7 -4.428 -2.004 12.125
37 2HB CYS 7 2HB CYS 7 -5.019 -0.538 12.882
38 H LEU 8 H LEU 8 -5.515 0.004 14.916
39 HA LEU 8 HA LEU 8 -6.670 -1.650 16.938
40 1HB LEU 8 1HB LEU 8 -6.485 0.682 17.340
41 2HB LEU 8 2HB LEU 8 -7.295 1.084 15.838
42 HG LEU 8 HG LEU 8 -9.396 0.093 16.733
43 1HD1 LEU 8 1HD1 LEU 8 -7.893 -1.269 18.484
44 2HD1 LEU 8 2HD1 LEU 8 -8.341 0.114 19.512
45 3HD1 LEU 8 3HD1 LEU 8 -9.609 -0.887 18.765
46 1HD2 LEU 8 1HD2 LEU 8 -8.030 2.445 17.968
47 2HD2 LEU 8 2HD2 LEU 8 -9.475 2.366 16.932
48 3HD2 LEU 8 3HD2 LEU 8 -9.586 1.912 18.649
49 H ALA 9 H ALA 9 -7.849 -0.243 13.802
50 HA ALA 9 HA ALA 9 -8.947 -2.412 12.709
51 1HB ALA 9 1HB ALA 9 -10.484 -1.620 15.104
52 2HB ALA 9 2HB ALA 9 -11.471 -1.800 13.635
53 3HB ALA 9 3HB ALA 9 -10.474 -3.158 14.209
54 H GLY 10 H GLY 10 -8.562 -1.265 10.822
55 1HA GLY 10 1HA GLY 10 -9.961 -0.087 9.192
56 2HA GLY 10 2HA GLY 10 -10.262 1.126 10.420
57 H TYR 11 H TYR 11 -7.605 1.286 11.565
58 HA TYR 11 HA TYR 11 -6.462 3.201 9.947
59 1HB TYR 11 1HB TYR 11 -5.373 1.245 12.062
60 2HB TYR 11 2HB TYR 11 -4.427 2.601 11.480
61 HD1 TYR 11 HD1 TYR 11 -5.642 4.967 11.656
62 HD2 TYR 11 HD2 TYR 11 -6.657 1.522 13.983
63 HE1 TYR 11 HE1 TYR 11 -6.713 6.461 13.414
64 HE2 TYR 11 HE2 TYR 11 -7.723 3.027 15.732
65 HH TYR 11 HH TYR 11 -8.140 6.452 15.153
66 H MET 12 H MET 12 -4.437 3.233 8.734
67 HA MET 12 HA MET 12 -3.992 0.651 7.456
68 1HB MET 12 1HB MET 12 -3.044 2.146 5.576
69 2HB MET 12 2HB MET 12 -4.767 2.307 5.854
70 1HG MET 12 1HG MET 12 -4.572 4.481 6.547
71 2HG MET 12 2HG MET 12 -3.184 4.133 7.557
72 1HE MET 12 1HE MET 12 -3.517 6.565 6.421
73 2HE MET 12 2HE MET 12 -2.070 7.024 5.491
74 3HE MET 12 3HE MET 12 -3.605 6.704 4.649
75 H ARG 13 H ARG 13 -1.667 0.374 6.554
76 HA ARG 13 HA ARG 13 0.105 1.137 8.705
77 1HB ARG 13 1HB ARG 13 -0.153 -1.170 6.886
78 2HB ARG 13 2HB ARG 13 1.497 -0.582 6.942
79 1HG ARG 13 1HG ARG 13 0.619 -0.545 9.642
80 2HG ARG 13 2HG ARG 13 -0.014 -2.041 8.984
81 1HD ARG 13 1HD ARG 13 2.173 -2.825 8.355
82 2HD ARG 13 2HD ARG 13 2.885 -1.233 8.526
83 HE ARG 13 HE ARG 13 1.713 -2.178 11.023
84 1HH1 ARG 13 1HH1 ARG 13 4.570 -2.357 8.977
85 2HH1 ARG 13 2HH1 ARG 13 5.634 -2.769 10.280
86 1HH2 ARG 13 1HH2 ARG 13 3.116 -2.721 12.742
87 2HH2 ARG 13 2HH2 ARG 13 4.802 -2.977 12.436
88 H THR 14 H THR 14 1.138 3.085 8.320
89 HA THR 14 HA THR 14 1.531 4.132 5.732
90 HB THR 14 HB THR 14 3.060 5.716 7.150
91 HG1 THR 14 HG1 THR 14 3.279 3.859 8.756
92 1HG2 THR 14 1HG2 THR 14 0.208 5.474 7.035
93 2HG2 THR 14 2HG2 THR 14 0.622 5.744 8.745
94 3HG2 THR 14 3HG2 THR 14 1.146 6.911 7.509
95 H ALA 15 H ALA 15 4.143 5.088 5.661
96 HA ALA 15 HA ALA 15 5.453 2.719 4.698
97 1HB ALA 15 1HB ALA 15 5.832 5.691 4.555
98 2HB ALA 15 2HB ALA 15 7.253 4.655 4.281
99 3HB ALA 15 3HB ALA 15 5.812 4.480 3.252
100 H ASP 16 H ASP 16 5.040 3.994 7.741
101 HA ASP 16 HA ASP 16 7.701 3.090 8.519
102 1HB ASP 16 1HB ASP 16 6.278 5.558 9.112
103 2HB ASP 16 2HB ASP 16 6.545 4.680 10.605
104 H GLY 17 H GLY 17 4.450 2.345 8.394
105 1HA GLY 17 1HA GLY 17 3.496 0.471 9.368
106 2HA GLY 17 2HA GLY 17 4.640 0.550 10.694
107 H ARG 18 H ARG 18 3.984 3.682 10.617
108 HA ARG 18 HA ARG 18 2.466 3.740 12.836
109 1HB ARG 18 1HB ARG 18 2.499 5.821 10.590
110 2HB ARG 18 2HB ARG 18 1.985 6.134 12.236
111 1HG ARG 18 1HG ARG 18 4.339 5.269 12.951
112 2HG ARG 18 2HG ARG 18 4.778 5.419 11.261
113 1HD ARG 18 1HD ARG 18 4.475 7.785 11.257
114 2HD ARG 18 2HD ARG 18 3.478 7.757 12.699
115 HE ARG 18 HE ARG 18 6.173 6.744 13.191
116 1HH1 ARG 18 1HH1 ARG 18 4.216 9.659 12.955
117 2HH1 ARG 18 2HH1 ARG 18 5.273 10.603 13.950
118 1HH2 ARG 18 1HH2 ARG 18 7.568 7.990 14.504
119 2HH2 ARG 18 2HH2 ARG 18 7.193 9.647 14.837
120 H CYS 19 H CYS 19 0.413 2.950 13.186
121 HA CYS 19 HA CYS 19 -1.334 2.326 11.115
122 1HB CYS 19 1HB CYS 19 -1.760 2.656 14.085
123 2HB CYS 19 2HB CYS 19 -3.032 2.141 12.996
124 H LYS 20 H LYS 20 -1.733 4.118 9.739
125 HA LYS 20 HA LYS 20 -2.710 6.559 10.981
126 1HB LYS 20 1HB LYS 20 -1.353 5.842 8.492
127 2HB LYS 20 2HB LYS 20 -2.726 6.896 8.217
128 1HG LYS 20 1HG LYS 20 -1.751 8.275 10.257
129 2HG LYS 20 2HG LYS 20 -0.269 7.403 9.922
130 1HD LYS 20 1HD LYS 20 -1.131 8.260 7.379
131 2HD LYS 20 2HD LYS 20 -1.511 9.613 8.425
132 1HE LYS 20 1HE LYS 20 1.163 8.417 8.938
133 2HE LYS 20 2HE LYS 20 0.990 9.098 7.333
134 1HZ LYS 20 1HZ LYS 20 -0.061 11.037 8.690
135 2HZ LYS 20 2HZ LYS 20 0.857 10.432 9.898
136 3HZ LYS 20 3HZ LYS 20 1.558 10.922 8.507
137 HA PRO 21 HA PRO 21 -6.841 5.878 9.918
138 1HB PRO 21 1HB PRO 21 -7.745 8.263 8.937
139 2HB PRO 21 2HB PRO 21 -7.519 7.954 10.647
140 1HG PRO 21 1HG PRO 21 -5.843 9.562 8.818
141 2HG PRO 21 2HG PRO 21 -5.888 9.583 10.570
142 1HD PRO 21 1HD PRO 21 -3.892 8.351 8.917
143 2HD PRO 21 2HD PRO 21 -4.000 8.273 10.664
144 H THR 22 H THR 22 -8.262 5.015 8.442
145 HA THR 22 HA THR 22 -7.281 5.291 5.676
146 HB THR 22 HB THR 22 -8.733 2.904 6.922
147 HG1 THR 22 HG1 THR 22 -6.648 3.322 7.951
148 1HG2 THR 22 1HG2 THR 22 -7.674 3.579 4.255
149 2HG2 THR 22 2HG2 THR 22 -6.898 2.123 4.924
150 3HG2 THR 22 3HG2 THR 22 -8.667 2.186 4.746
151 H PHE 23 H PHE 23 -9.491 6.601 7.618
152 HA PHE 23 HA PHE 23 -11.723 6.198 5.776
153 1HB PHE 23 1HB PHE 23 -12.903 7.478 7.699
154 2HB PHE 23 2HB PHE 23 -12.265 5.907 8.140
155 HD1 PHE 23 HD1 PHE 23 -11.257 9.500 8.103
156 HD2 PHE 23 HD2 PHE 23 -10.949 5.734 10.034
157 HE1 PHE 23 HE1 PHE 23 -9.935 10.558 9.956
158 HE2 PHE 23 HE2 PHE 23 -9.627 6.792 11.887
159 HZ PHE 23 HZ PHE 23 -9.135 9.191 11.825
Start of MODEL 20
1 H GLU 1 H GLU 1 0.705 -6.234 0.727
2 HA GLU 1 HA GLU 1 2.004 -5.551 2.611
3 1HB GLU 1 1HB GLU 1 1.503 -3.019 2.457
4 2HB GLU 1 2HB GLU 1 1.917 -3.847 0.969
5 1HG GLU 1 1HG GLU 1 -0.051 -3.196 0.059
6 2HG GLU 1 2HG GLU 1 -0.918 -4.114 1.275
7 H ASN 2 H ASN 2 -1.519 -5.359 2.946
8 HA ASN 2 HA ASN 2 -1.569 -4.025 5.381
9 1HB ASN 2 1HB ASN 2 -3.433 -5.543 3.666
10 2HB ASN 2 2HB ASN 2 -3.775 -5.803 5.365
11 1HD2 ASN 2 2HD2 ASN 2 -5.712 -4.633 4.178
12 2HD2 ASN 2 1HD2 ASN 2 -5.803 -2.924 4.448
13 H PHE 3 H PHE 3 -2.448 -5.207 7.482
14 HA PHE 3 HA PHE 3 -1.526 -7.946 7.701
15 1HB PHE 3 1HB PHE 3 0.262 -5.985 8.250
16 2HB PHE 3 2HB PHE 3 -0.651 -5.855 9.740
17 HD1 PHE 3 HD1 PHE 3 -1.017 -8.125 11.026
18 HD2 PHE 3 HD2 PHE 3 2.037 -7.466 8.153
19 HE1 PHE 3 HE1 PHE 3 0.312 -10.016 12.004
20 HE2 PHE 3 HE2 PHE 3 3.366 -9.356 9.132
21 HZ PHE 3 HZ PHE 3 2.487 -10.609 11.046
22 H ASN 4 H ASN 4 -2.745 -5.030 9.492
23 HA ASN 4 HA ASN 4 -4.386 -4.771 10.886
24 1HB ASN 4 1HB ASN 4 -5.809 -5.925 9.193
25 2HB ASN 4 2HB ASN 4 -5.368 -7.485 9.857
26 1HD2 ASN 4 2HD2 ASN 4 -6.695 -4.333 10.833
27 2HD2 ASN 4 1HD2 ASN 4 -7.868 -4.926 11.963
28 H GLY 5 H GLY 5 -1.869 -6.309 11.581
29 1HA GLY 5 1HA GLY 5 -2.881 -7.964 13.813
30 2HA GLY 5 2HA GLY 5 -1.349 -8.196 12.996
31 H GLY 6 H GLY 6 -2.782 -5.022 13.917
32 1HA GLY 6 1HA GLY 6 -1.274 -4.734 16.315
33 2HA GLY 6 2HA GLY 6 -0.466 -3.951 14.970
34 H CYS 7 H CYS 7 -2.518 -2.942 13.401
35 HA CYS 7 HA CYS 7 -3.160 -0.607 14.653
36 1HB CYS 7 1HB CYS 7 -4.511 -2.017 12.349
37 2HB CYS 7 2HB CYS 7 -4.938 -0.397 12.862
38 H LEU 8 H LEU 8 -5.760 0.047 14.732
39 HA LEU 8 HA LEU 8 -6.770 -1.626 16.861
40 1HB LEU 8 1HB LEU 8 -6.743 0.718 17.253
41 2HB LEU 8 2HB LEU 8 -7.556 1.057 15.739
42 HG LEU 8 HG LEU 8 -9.603 -0.044 16.601
43 1HD1 LEU 8 1HD1 LEU 8 -8.374 -1.547 18.207
44 2HD1 LEU 8 2HD1 LEU 8 -8.224 -0.143 19.291
45 3HD1 LEU 8 3HD1 LEU 8 -9.835 -0.762 18.852
46 1HD2 LEU 8 1HD2 LEU 8 -8.458 2.247 18.213
47 2HD2 LEU 8 2HD2 LEU 8 -9.498 2.330 16.770
48 3HD2 LEU 8 3HD2 LEU 8 -10.156 1.717 18.306
49 H ALA 9 H ALA 9 -7.973 -0.305 13.696
50 HA ALA 9 HA ALA 9 -8.904 -2.546 12.592
51 1HB ALA 9 1HB ALA 9 -10.559 -1.820 14.938
52 2HB ALA 9 2HB ALA 9 -11.481 -2.112 13.443
53 3HB ALA 9 3HB ALA 9 -10.402 -3.375 14.085
54 H GLY 10 H GLY 10 -8.573 -1.406 10.695
55 1HA GLY 10 1HA GLY 10 -10.014 -0.320 9.038
56 2HA GLY 10 2HA GLY 10 -10.389 0.889 10.251
57 H TYR 11 H TYR 11 -7.754 1.193 11.420
58 HA TYR 11 HA TYR 11 -6.693 3.146 9.785
59 1HB TYR 11 1HB TYR 11 -5.531 1.288 11.950
60 2HB TYR 11 2HB TYR 11 -4.657 2.688 11.360
61 HD1 TYR 11 HD1 TYR 11 -7.567 1.559 13.323
62 HD2 TYR 11 HD2 TYR 11 -5.303 4.942 12.005
63 HE1 TYR 11 HE1 TYR 11 -8.745 3.023 15.034
64 HE2 TYR 11 HE2 TYR 11 -6.489 6.395 13.722
65 HH TYR 11 HH TYR 11 -8.209 6.505 15.101
66 H MET 12 H MET 12 -4.596 3.253 8.662
67 HA MET 12 HA MET 12 -4.037 0.689 7.391
68 1HB MET 12 1HB MET 12 -3.067 2.221 5.549
69 2HB MET 12 2HB MET 12 -4.803 2.322 5.765
70 1HG MET 12 1HG MET 12 -4.713 4.461 6.683
71 2HG MET 12 2HG MET 12 -3.150 4.196 7.432
72 1HE MET 12 1HE MET 12 -4.129 6.693 6.039
73 2HE MET 12 2HE MET 12 -2.386 6.800 6.387
74 3HE MET 12 3HE MET 12 -2.995 7.191 4.761
75 H ARG 13 H ARG 13 -1.699 0.395 6.637
76 HA ARG 13 HA ARG 13 0.008 1.411 8.753
77 1HB ARG 13 1HB ARG 13 0.186 -1.053 6.959
78 2HB ARG 13 2HB ARG 13 1.536 -0.533 7.949
79 1HG ARG 13 1HG ARG 13 -0.775 -0.519 9.647
80 2HG ARG 13 2HG ARG 13 -0.830 -2.019 8.742
81 1HD ARG 13 1HD ARG 13 1.893 -1.401 9.708
82 2HD ARG 13 2HD ARG 13 0.738 -1.522 11.020
83 HE ARG 13 HE ARG 13 0.176 -3.725 9.391
84 1HH1 ARG 13 1HH1 ARG 13 3.004 -2.525 11.108
85 2HH1 ARG 13 2HH1 ARG 13 3.681 -4.101 11.354
86 1HH2 ARG 13 1HH2 ARG 13 1.068 -5.803 9.717
87 2HH2 ARG 13 2HH2 ARG 13 2.572 -5.978 10.558
88 H THR 14 H THR 14 1.124 3.227 8.077
89 HA THR 14 HA THR 14 1.606 3.782 5.346
90 HB THR 14 HB THR 14 3.079 5.608 6.491
91 HG1 THR 14 HG1 THR 14 2.541 5.584 8.869
92 1HG2 THR 14 1HG2 THR 14 0.548 5.853 5.966
93 2HG2 THR 14 2HG2 THR 14 0.265 5.376 7.658
94 3HG2 THR 14 3HG2 THR 14 1.175 6.862 7.292
95 H ALA 15 H ALA 15 4.230 4.699 5.210
96 HA ALA 15 HA ALA 15 5.563 2.161 4.853
97 1HB ALA 15 1HB ALA 15 6.268 5.032 4.128
98 2HB ALA 15 2HB ALA 15 7.265 3.617 3.713
99 3HB ALA 15 3HB ALA 15 5.623 3.777 3.042
100 H ASP 16 H ASP 16 5.008 3.902 7.524
101 HA ASP 16 HA ASP 16 7.766 3.673 8.440
102 1HB ASP 16 1HB ASP 16 6.800 5.967 8.577
103 2HB ASP 16 2HB ASP 16 5.457 5.357 9.523
104 H GLY 17 H GLY 17 4.496 2.502 8.615
105 1HA GLY 17 1HA GLY 17 3.929 0.509 9.687
106 2HA GLY 17 2HA GLY 17 5.204 0.756 10.862
107 H ARG 18 H ARG 18 3.846 3.781 10.502
108 HA ARG 18 HA ARG 18 2.523 3.539 12.984
109 1HB ARG 18 1HB ARG 18 2.592 5.892 11.027
110 2HB ARG 18 2HB ARG 18 2.102 5.984 12.707
111 1HG ARG 18 1HG ARG 18 4.807 4.795 12.145
112 2HG ARG 18 2HG ARG 18 4.633 6.520 11.893
113 1HD ARG 18 1HD ARG 18 3.485 6.492 14.286
114 2HD ARG 18 2HD ARG 18 4.291 4.946 14.463
115 HE ARG 18 HE ARG 18 6.250 6.739 13.501
116 1HH1 ARG 18 1HH1 ARG 18 4.213 6.413 16.352
117 2HH1 ARG 18 2HH1 ARG 18 5.335 7.212 17.402
118 1HH2 ARG 18 1HH2 ARG 18 7.731 7.793 14.886
119 2HH2 ARG 18 2HH2 ARG 18 7.349 8.003 16.562
120 H CYS 19 H CYS 19 0.457 2.726 13.167
121 HA CYS 19 HA CYS 19 -1.220 2.334 11.002
122 1HB CYS 19 1HB CYS 19 -1.823 2.466 13.962
123 2HB CYS 19 2HB CYS 19 -2.989 1.969 12.751
124 H LYS 20 H LYS 20 -1.939 4.030 9.738
125 HA LYS 20 HA LYS 20 -2.765 6.472 11.125
126 1HB LYS 20 1HB LYS 20 -1.359 5.915 8.653
127 2HB LYS 20 2HB LYS 20 -2.788 6.878 8.337
128 1HG LYS 20 1HG LYS 20 -1.382 8.613 8.905
129 2HG LYS 20 2HG LYS 20 -1.901 8.204 10.528
130 1HD LYS 20 1HD LYS 20 0.108 7.078 11.041
131 2HD LYS 20 2HD LYS 20 0.475 6.743 9.360
132 1HE LYS 20 1HE LYS 20 1.463 8.803 9.015
133 2HE LYS 20 2HE LYS 20 0.331 9.644 10.055
134 1HZ LYS 20 1HZ LYS 20 2.282 7.808 11.210
135 2HZ LYS 20 2HZ LYS 20 2.718 9.335 10.831
136 3HZ LYS 20 3HZ LYS 20 1.524 9.071 11.914
137 HA PRO 21 HA PRO 21 -6.906 5.846 10.074
138 1HB PRO 21 1HB PRO 21 -7.827 8.298 9.295
139 2HB PRO 21 2HB PRO 21 -7.579 7.855 10.972
140 1HG PRO 21 1HG PRO 21 -5.930 9.608 9.255
141 2HG PRO 21 2HG PRO 21 -5.952 9.490 11.004
142 1HD PRO 21 1HD PRO 21 -3.975 8.399 9.235
143 2HD PRO 21 2HD PRO 21 -4.061 8.184 10.972
144 H THR 22 H THR 22 -8.372 5.133 8.549
145 HA THR 22 HA THR 22 -7.421 5.624 5.802
146 HB THR 22 HB THR 22 -8.559 3.126 7.155
147 HG1 THR 22 HG1 THR 22 -6.180 3.722 5.547
148 1HG2 THR 22 1HG2 THR 22 -8.224 3.866 4.230
149 2HG2 THR 22 2HG2 THR 22 -7.900 2.195 4.752
150 3HG2 THR 22 3HG2 THR 22 -9.513 2.907 4.996
151 H PHE 23 H PHE 23 -9.595 6.775 7.863
152 HA PHE 23 HA PHE 23 -12.098 6.344 7.136
153 1HB PHE 23 1HB PHE 23 -10.788 9.125 7.118
154 2HB PHE 23 2HB PHE 23 -12.434 8.765 7.602
155 HD1 PHE 23 HD1 PHE 23 -12.127 6.489 9.398
156 HD2 PHE 23 HD2 PHE 23 -9.701 9.947 8.985
157 HE1 PHE 23 HE1 PHE 23 -11.373 6.245 11.780
158 HE2 PHE 23 HE2 PHE 23 -8.948 9.702 11.367
159 HZ PHE 23 HZ PHE 23 -9.792 7.855 12.735
Start of MODEL 21
1 H GLU 1 H GLU 1 4.907 -9.555 17.270
2 HA GLU 1 HA GLU 1 2.868 -10.799 17.257
3 1HB GLU 1 1HB GLU 1 4.114 -9.747 19.479
4 2HB GLU 1 2HB GLU 1 2.470 -9.196 19.733
5 1HG GLU 1 1HG GLU 1 1.979 -11.263 20.528
6 2HG GLU 1 2HG GLU 1 2.162 -11.871 18.895
7 H ASN 2 H ASN 2 1.817 -9.456 15.373
8 HA ASN 2 HA ASN 2 -0.588 -8.320 16.513
9 1HB ASN 2 1HB ASN 2 0.931 -7.028 14.187
10 2HB ASN 2 2HB ASN 2 -0.556 -6.436 14.900
11 1HD2 ASN 2 2HD2 ASN 2 -0.510 -5.937 17.235
12 2HD2 ASN 2 1HD2 ASN 2 0.907 -5.201 17.906
13 H PHE 3 H PHE 3 -2.261 -8.013 14.546
14 HA PHE 3 HA PHE 3 -2.194 -10.494 13.077
15 1HB PHE 3 1HB PHE 3 -4.094 -8.388 13.986
16 2HB PHE 3 2HB PHE 3 -4.434 -8.902 12.346
17 HD1 PHE 3 HD1 PHE 3 -4.778 -11.397 11.923
18 HD2 PHE 3 HD2 PHE 3 -4.776 -9.695 15.812
19 HE1 PHE 3 HE1 PHE 3 -5.994 -13.408 12.805
20 HE2 PHE 3 HE2 PHE 3 -5.992 -11.707 16.692
21 HZ PHE 3 HZ PHE 3 -6.585 -13.540 15.178
22 H ASN 4 H ASN 4 -2.804 -7.002 12.237
23 HA ASN 4 HA ASN 4 -1.517 -7.602 9.690
24 1HB ASN 4 1HB ASN 4 -3.129 -5.547 8.971
25 2HB ASN 4 2HB ASN 4 -3.673 -7.211 8.899
26 1HD2 ASN 4 2HD2 ASN 4 -3.732 -4.218 10.700
27 2HD2 ASN 4 1HD2 ASN 4 -5.116 -4.549 11.689
28 H GLY 5 H GLY 5 0.070 -6.730 11.760
29 1HA GLY 5 1HA GLY 5 1.736 -5.035 11.603
30 2HA GLY 5 2HA GLY 5 0.505 -3.881 11.127
31 H GLY 6 H GLY 6 -1.541 -4.634 13.067
32 1HA GLY 6 1HA GLY 6 -1.700 -4.841 15.459
33 2HA GLY 6 2HA GLY 6 -0.199 -3.949 15.610
34 H CYS 7 H CYS 7 -3.324 -3.477 13.793
35 HA CYS 7 HA CYS 7 -3.257 -0.704 14.707
36 1HB CYS 7 1HB CYS 7 -4.689 -2.020 12.394
37 2HB CYS 7 2HB CYS 7 -4.984 -0.370 12.901
38 H LEU 8 H LEU 8 -5.779 0.118 14.830
39 HA LEU 8 HA LEU 8 -6.901 -1.488 16.937
40 1HB LEU 8 1HB LEU 8 -6.787 0.859 17.280
41 2HB LEU 8 2HB LEU 8 -7.570 1.199 15.749
42 HG LEU 8 HG LEU 8 -9.666 0.182 16.617
43 1HD1 LEU 8 1HD1 LEU 8 -8.119 -1.061 18.466
44 2HD1 LEU 8 2HD1 LEU 8 -8.765 0.290 19.428
45 3HD1 LEU 8 3HD1 LEU 8 -9.879 -0.834 18.612
46 1HD2 LEU 8 1HD2 LEU 8 -8.394 2.567 17.917
47 2HD2 LEU 8 2HD2 LEU 8 -9.731 2.481 16.746
48 3HD2 LEU 8 3HD2 LEU 8 -10.006 2.024 18.444
49 H ALA 9 H ALA 9 -8.024 -0.194 13.733
50 HA ALA 9 HA ALA 9 -9.035 -2.420 12.668
51 1HB ALA 9 1HB ALA 9 -10.639 -1.634 15.009
52 2HB ALA 9 2HB ALA 9 -11.602 -1.810 13.523
53 3HB ALA 9 3HB ALA 9 -10.611 -3.167 14.108
54 H GLY 10 H GLY 10 -8.698 -1.374 10.729
55 1HA GLY 10 1HA GLY 10 -10.049 -0.260 9.041
56 2HA GLY 10 2HA GLY 10 -10.420 0.980 10.222
57 H TYR 11 H TYR 11 -7.779 1.214 11.432
58 HA TYR 11 HA TYR 11 -6.651 3.114 9.762
59 1HB TYR 11 1HB TYR 11 -5.557 1.313 12.010
60 2HB TYR 11 2HB TYR 11 -4.685 2.712 11.417
61 HD1 TYR 11 HD1 TYR 11 -5.938 5.007 11.541
62 HD2 TYR 11 HD2 TYR 11 -7.069 1.544 13.783
63 HE1 TYR 11 HE1 TYR 11 -7.185 6.479 13.198
64 HE2 TYR 11 HE2 TYR 11 -8.313 3.027 15.432
65 HH TYR 11 HH TYR 11 -8.381 5.219 16.181
66 H MET 12 H MET 12 -4.524 3.140 8.694
67 HA MET 12 HA MET 12 -3.910 0.494 7.622
68 1HB MET 12 1HB MET 12 -3.067 1.837 5.602
69 2HB MET 12 2HB MET 12 -4.795 1.943 5.866
70 1HG MET 12 1HG MET 12 -4.562 4.131 6.956
71 2HG MET 12 2HG MET 12 -2.814 4.006 6.940
72 1HE MET 12 1HE MET 12 -3.766 6.330 6.234
73 2HE MET 12 2HE MET 12 -2.445 6.475 5.050
74 3HE MET 12 3HE MET 12 -4.124 6.791 4.552
75 H ARG 13 H ARG 13 -1.556 0.292 6.816
76 HA ARG 13 HA ARG 13 0.106 1.524 8.846
77 1HB ARG 13 1HB ARG 13 0.330 -0.852 8.945
78 2HB ARG 13 2HB ARG 13 0.318 -1.022 7.201
79 1HG ARG 13 1HG ARG 13 2.540 0.687 8.087
80 2HG ARG 13 2HG ARG 13 2.596 -0.881 8.869
81 1HD ARG 13 1HD ARG 13 1.982 -1.546 6.220
82 2HD ARG 13 2HD ARG 13 3.064 -0.181 6.029
83 HE ARG 13 HE ARG 13 4.383 -1.694 7.907
84 1HH1 ARG 13 1HH1 ARG 13 2.983 -2.479 4.776
85 2HH1 ARG 13 2HH1 ARG 13 4.109 -3.754 4.449
86 1HH2 ARG 13 1HH2 ARG 13 5.869 -3.375 7.476
87 2HH2 ARG 13 2HH2 ARG 13 5.762 -4.267 5.995
88 H THR 14 H THR 14 1.022 3.418 8.073
89 HA THR 14 HA THR 14 1.402 3.976 5.356
90 HB THR 14 HB THR 14 2.529 5.965 6.235
91 HG1 THR 14 HG1 THR 14 2.554 4.415 8.725
92 1HG2 THR 14 1HG2 THR 14 0.003 5.436 6.988
93 2HG2 THR 14 2HG2 THR 14 0.760 5.280 8.591
94 3HG2 THR 14 3HG2 THR 14 0.888 6.810 7.692
95 H ALA 15 H ALA 15 4.119 5.027 5.396
96 HA ALA 15 HA ALA 15 5.438 2.519 4.745
97 1HB ALA 15 1HB ALA 15 5.338 4.406 3.112
98 2HB ALA 15 2HB ALA 15 6.270 5.406 4.251
99 3HB ALA 15 3HB ALA 15 7.005 3.950 3.537
100 H ASP 16 H ASP 16 4.925 4.045 7.542
101 HA ASP 16 HA ASP 16 7.708 3.790 8.373
102 1HB ASP 16 1HB ASP 16 6.065 5.982 8.654
103 2HB ASP 16 2HB ASP 16 5.744 5.156 10.166
104 H GLY 17 H GLY 17 4.516 2.498 8.471
105 1HA GLY 17 1HA GLY 17 3.954 0.479 9.455
106 2HA GLY 17 2HA GLY 17 5.261 0.653 10.610
107 H ARG 18 H ARG 18 3.840 3.683 10.464
108 HA ARG 18 HA ARG 18 2.592 3.253 12.968
109 1HB ARG 18 1HB ARG 18 2.783 5.715 11.163
110 2HB ARG 18 2HB ARG 18 2.071 5.748 12.764
111 1HG ARG 18 1HG ARG 18 4.354 4.671 13.541
112 2HG ARG 18 2HG ARG 18 4.964 5.242 12.001
113 1HD ARG 18 1HD ARG 18 3.403 7.210 13.661
114 2HD ARG 18 2HD ARG 18 5.001 6.778 14.235
115 HE ARG 18 HE ARG 18 4.948 7.437 11.381
116 1HH1 ARG 18 1HH1 ARG 18 5.228 8.749 14.634
117 2HH1 ARG 18 2HH1 ARG 18 6.053 10.183 14.122
118 1HH2 ARG 18 1HH2 ARG 18 6.036 9.329 10.705
119 2HH2 ARG 18 2HH2 ARG 18 6.515 10.516 11.872
120 H CYS 19 H CYS 19 0.517 2.474 13.159
121 HA CYS 19 HA CYS 19 -1.203 2.177 11.028
122 1HB CYS 19 1HB CYS 19 -1.768 2.277 13.995
123 2HB CYS 19 2HB CYS 19 -2.956 1.819 12.792
124 H LYS 20 H LYS 20 -1.930 3.897 9.798
125 HA LYS 20 HA LYS 20 -2.737 6.312 11.253
126 1HB LYS 20 1HB LYS 20 -1.163 5.887 8.898
127 2HB LYS 20 2HB LYS 20 -2.621 6.740 8.433
128 1HG LYS 20 1HG LYS 20 -1.504 8.607 9.139
129 2HG LYS 20 2HG LYS 20 -1.982 8.090 10.744
130 1HD LYS 20 1HD LYS 20 0.309 6.566 10.302
131 2HD LYS 20 2HD LYS 20 0.700 8.061 9.475
132 1HE LYS 20 1HE LYS 20 -0.525 8.811 11.955
133 2HE LYS 20 2HE LYS 20 0.616 7.535 12.334
134 1HZ LYS 20 1HZ LYS 20 1.729 9.346 10.493
135 2HZ LYS 20 2HZ LYS 20 1.203 10.144 11.818
136 3HZ LYS 20 3HZ LYS 20 2.273 8.919 11.973
137 HA PRO 21 HA PRO 21 -6.832 5.808 9.963
138 1HB PRO 21 1HB PRO 21 -7.656 8.260 9.081
139 2HB PRO 21 2HB PRO 21 -7.506 7.852 10.779
140 1HG PRO 21 1HG PRO 21 -5.731 9.528 9.112
141 2HG PRO 21 2HG PRO 21 -5.847 9.452 10.859
142 1HD PRO 21 1HD PRO 21 -3.805 8.278 9.222
143 2HD PRO 21 2HD PRO 21 -3.987 8.105 10.956
144 H THR 22 H THR 22 -8.243 5.106 8.376
145 HA THR 22 HA THR 22 -7.270 5.660 5.657
146 HB THR 22 HB THR 22 -7.590 3.063 7.126
147 HG1 THR 22 HG1 THR 22 -6.236 3.959 4.683
148 1HG2 THR 22 1HG2 THR 22 -8.391 3.491 4.203
149 2HG2 THR 22 2HG2 THR 22 -7.913 1.912 4.869
150 3HG2 THR 22 3HG2 THR 22 -9.373 2.730 5.477
151 H PHE 23 H PHE 23 -9.643 6.260 7.806
152 HA PHE 23 HA PHE 23 -11.837 5.644 6.002
153 1HB PHE 23 1HB PHE 23 -13.132 6.598 8.011
154 2HB PHE 23 2HB PHE 23 -12.145 5.204 8.404
155 HD1 PHE 23 HD1 PHE 23 -11.963 8.930 8.366
156 HD2 PHE 23 HD2 PHE 23 -10.717 5.322 10.221
157 HE1 PHE 23 HE1 PHE 23 -10.813 10.252 10.164
158 HE2 PHE 23 HE2 PHE 23 -9.567 6.644 12.018
159 HZ PHE 23 HZ PHE 23 -9.628 9.092 11.968
Start of MODEL 22
1 H GLU 1 H GLU 1 -2.301 -16.568 15.835
2 HA GLU 1 HA GLU 1 -0.278 -16.066 14.668
3 1HB GLU 1 1HB GLU 1 -2.902 -15.922 13.169
4 2HB GLU 1 2HB GLU 1 -1.395 -15.786 12.286
5 1HG GLU 1 1HG GLU 1 -1.436 -18.014 14.255
6 2HG GLU 1 2HG GLU 1 -2.625 -18.176 12.978
7 H ASN 2 H ASN 2 -2.851 -13.611 13.868
8 HA ASN 2 HA ASN 2 -1.274 -11.451 14.495
9 1HB ASN 2 1HB ASN 2 0.030 -12.282 12.443
10 2HB ASN 2 2HB ASN 2 -1.393 -11.950 11.475
11 1HD2 ASN 2 2HD2 ASN 2 -0.233 -10.451 10.259
12 2HD2 ASN 2 1HD2 ASN 2 0.128 -8.857 10.833
13 H PHE 3 H PHE 3 -2.370 -9.354 13.640
14 HA PHE 3 HA PHE 3 -5.200 -9.929 13.166
15 1HB PHE 3 1HB PHE 3 -3.806 -8.374 15.049
16 2HB PHE 3 2HB PHE 3 -4.234 -7.174 13.846
17 HD1 PHE 3 HD1 PHE 3 -5.793 -9.932 15.819
18 HD2 PHE 3 HD2 PHE 3 -6.290 -6.127 14.007
19 HE1 PHE 3 HE1 PHE 3 -8.093 -9.760 16.810
20 HE2 PHE 3 HE2 PHE 3 -8.590 -5.955 14.997
21 HZ PHE 3 HZ PHE 3 -9.464 -7.773 16.388
22 H ASN 4 H ASN 4 -2.791 -7.306 12.401
23 HA ASN 4 HA ASN 4 -3.010 -7.558 9.686
24 1HB ASN 4 1HB ASN 4 -5.387 -6.836 9.984
25 2HB ASN 4 2HB ASN 4 -4.858 -5.404 10.844
26 1HD2 ASN 4 2HD2 ASN 4 -4.772 -3.629 9.718
27 2HD2 ASN 4 1HD2 ASN 4 -4.504 -3.470 8.014
28 H GLY 5 H GLY 5 -0.980 -7.086 11.602
29 1HA GLY 5 1HA GLY 5 0.940 -5.742 11.239
30 2HA GLY 5 2HA GLY 5 -0.090 -4.378 10.853
31 H GLY 6 H GLY 6 -2.018 -4.729 13.036
32 1HA GLY 6 1HA GLY 6 -1.790 -4.950 15.476
33 2HA GLY 6 2HA GLY 6 -0.274 -4.083 15.339
34 H CYS 7 H CYS 7 -3.487 -3.534 13.737
35 HA CYS 7 HA CYS 7 -3.337 -0.792 14.733
36 1HB CYS 7 1HB CYS 7 -4.809 -2.000 12.388
37 2HB CYS 7 2HB CYS 7 -5.086 -0.366 12.958
38 H LEU 8 H LEU 8 -5.955 0.007 14.721
39 HA LEU 8 HA LEU 8 -7.059 -1.602 16.859
40 1HB LEU 8 1HB LEU 8 -6.908 0.736 17.256
41 2HB LEU 8 2HB LEU 8 -7.690 1.122 15.735
42 HG LEU 8 HG LEU 8 -9.800 0.124 16.580
43 1HD1 LEU 8 1HD1 LEU 8 -8.204 -1.136 18.441
44 2HD1 LEU 8 2HD1 LEU 8 -9.011 0.130 19.398
45 3HD1 LEU 8 3HD1 LEU 8 -9.981 -1.041 18.474
46 1HD2 LEU 8 1HD2 LEU 8 -8.651 2.592 17.213
47 2HD2 LEU 8 2HD2 LEU 8 -10.376 2.156 17.268
48 3HD2 LEU 8 3HD2 LEU 8 -9.376 2.017 18.733
49 H ALA 9 H ALA 9 -8.159 -0.211 13.687
50 HA ALA 9 HA ALA 9 -9.199 -2.395 12.565
51 1HB ALA 9 1HB ALA 9 -10.826 -1.605 14.906
52 2HB ALA 9 2HB ALA 9 -11.756 -1.824 13.405
53 3HB ALA 9 3HB ALA 9 -10.754 -3.154 14.032
54 H GLY 10 H GLY 10 -8.769 -1.245 10.688
55 1HA GLY 10 1HA GLY 10 -10.138 -0.084 9.017
56 2HA GLY 10 2HA GLY 10 -10.478 1.130 10.234
57 H TYR 11 H TYR 11 -7.723 1.068 11.403
58 HA TYR 11 HA TYR 11 -6.572 3.010 9.689
59 1HB TYR 11 1HB TYR 11 -5.584 1.355 12.096
60 2HB TYR 11 2HB TYR 11 -4.723 2.748 11.473
61 HD1 TYR 11 HD1 TYR 11 -5.767 5.034 11.643
62 HD2 TYR 11 HD2 TYR 11 -7.462 1.604 13.557
63 HE1 TYR 11 HE1 TYR 11 -7.135 6.548 13.161
64 HE2 TYR 11 HE2 TYR 11 -8.824 3.129 15.068
65 HH TYR 11 HH TYR 11 -8.286 5.834 15.851
66 H MET 12 H MET 12 -4.473 2.937 8.640
67 HA MET 12 HA MET 12 -3.740 0.202 7.926
68 1HB MET 12 1HB MET 12 -2.919 1.373 5.741
69 2HB MET 12 2HB MET 12 -4.652 1.226 5.947
70 1HG MET 12 1HG MET 12 -4.955 3.498 6.199
71 2HG MET 12 2HG MET 12 -3.492 3.696 7.143
72 1HE MET 12 1HE MET 12 -3.478 6.002 5.656
73 2HE MET 12 2HE MET 12 -3.226 6.018 3.895
74 3HE MET 12 3HE MET 12 -4.772 5.448 4.567
75 H ARG 13 H ARG 13 -1.384 -0.013 7.183
76 HA ARG 13 HA ARG 13 0.203 1.575 9.003
77 1HB ARG 13 1HB ARG 13 0.162 -1.112 8.685
78 2HB ARG 13 2HB ARG 13 1.351 -0.747 7.451
79 1HG ARG 13 1HG ARG 13 2.867 -0.785 9.157
80 2HG ARG 13 2HG ARG 13 2.267 0.817 9.538
81 1HD ARG 13 1HD ARG 13 1.126 0.096 11.409
82 2HD ARG 13 2HD ARG 13 0.614 -1.399 10.651
83 HE ARG 13 HE ARG 13 3.086 -0.967 12.183
84 1HH1 ARG 13 1HH1 ARG 13 1.419 -3.032 9.872
85 2HH1 ARG 13 2HH1 ARG 13 2.390 -4.423 10.221
86 1HH2 ARG 13 1HH2 ARG 13 4.368 -2.802 12.643
87 2HH2 ARG 13 2HH2 ARG 13 4.079 -4.291 11.808
88 H THR 14 H THR 14 1.033 3.420 8.053
89 HA THR 14 HA THR 14 1.319 3.770 5.297
90 HB THR 14 HB THR 14 2.460 5.845 5.993
91 HG1 THR 14 HG1 THR 14 3.664 5.682 7.847
92 1HG2 THR 14 1HG2 THR 14 -0.082 5.305 6.768
93 2HG2 THR 14 2HG2 THR 14 0.672 5.392 8.379
94 3HG2 THR 14 3HG2 THR 14 0.752 6.791 7.281
95 H ALA 15 H ALA 15 4.043 4.936 5.287
96 HA ALA 15 HA ALA 15 5.418 2.424 4.736
97 1HB ALA 15 1HB ALA 15 5.530 5.244 3.753
98 2HB ALA 15 2HB ALA 15 7.059 4.332 3.766
99 3HB ALA 15 3HB ALA 15 5.661 3.713 2.854
100 H ASP 16 H ASP 16 4.911 4.085 7.439
101 HA ASP 16 HA ASP 16 7.725 4.063 8.198
102 1HB ASP 16 1HB ASP 16 6.520 6.263 8.415
103 2HB ASP 16 2HB ASP 16 5.370 5.509 9.502
104 H GLY 17 H GLY 17 4.561 2.648 8.548
105 1HA GLY 17 1HA GLY 17 4.238 0.583 9.600
106 2HA GLY 17 2HA GLY 17 5.539 0.933 10.721
107 H ARG 18 H ARG 18 3.784 3.796 10.368
108 HA ARG 18 HA ARG 18 2.583 3.363 12.921
109 1HB ARG 18 1HB ARG 18 2.248 5.745 12.967
110 2HB ARG 18 2HB ARG 18 3.794 5.511 12.175
111 1HG ARG 18 1HG ARG 18 2.314 5.470 9.954
112 2HG ARG 18 2HG ARG 18 1.141 6.303 10.955
113 1HD ARG 18 1HD ARG 18 3.637 7.583 11.478
114 2HD ARG 18 2HD ARG 18 3.583 7.348 9.742
115 HE ARG 18 HE ARG 18 1.048 8.356 10.722
116 1HH1 ARG 18 1HH1 ARG 18 4.329 9.345 9.922
117 2HH1 ARG 18 2HH1 ARG 18 3.889 10.985 9.583
118 1HH2 ARG 18 1HH2 ARG 18 0.466 10.520 10.274
119 2HH2 ARG 18 2HH2 ARG 18 1.677 11.658 9.785
120 H CYS 19 H CYS 19 0.486 2.662 13.179
121 HA CYS 19 HA CYS 19 -1.163 2.183 10.988
122 1HB CYS 19 1HB CYS 19 -1.707 2.272 13.956
123 2HB CYS 19 2HB CYS 19 -2.940 1.853 12.782
124 H LYS 20 H LYS 20 -1.679 3.988 9.718
125 HA LYS 20 HA LYS 20 -2.621 6.376 11.093
126 1HB LYS 20 1HB LYS 20 -1.397 5.763 8.471
127 2HB LYS 20 2HB LYS 20 -2.666 6.970 8.427
128 1HG LYS 20 1HG LYS 20 -1.145 7.634 10.720
129 2HG LYS 20 2HG LYS 20 0.050 7.173 9.524
130 1HD LYS 20 1HD LYS 20 -0.276 9.084 8.339
131 2HD LYS 20 2HD LYS 20 -2.009 8.830 8.283
132 1HE LYS 20 1HE LYS 20 -2.371 9.974 10.352
133 2HE LYS 20 2HE LYS 20 -0.691 9.833 10.830
134 1HZ LYS 20 1HZ LYS 20 -0.118 11.326 9.033
135 2HZ LYS 20 2HZ LYS 20 -1.685 11.461 8.594
136 3HZ LYS 20 3HZ LYS 20 -1.191 12.029 10.043
137 HA PRO 21 HA PRO 21 -6.763 5.706 10.075
138 1HB PRO 21 1HB PRO 21 -7.713 8.168 9.366
139 2HB PRO 21 2HB PRO 21 -7.449 7.685 11.030
140 1HG PRO 21 1HG PRO 21 -5.830 9.498 9.348
141 2HG PRO 21 2HG PRO 21 -5.839 9.335 11.093
142 1HD PRO 21 1HD PRO 21 -3.864 8.310 9.283
143 2HD PRO 21 2HD PRO 21 -3.934 8.049 11.014
144 H THR 22 H THR 22 -8.181 4.954 8.545
145 HA THR 22 HA THR 22 -7.171 5.392 5.818
146 HB THR 22 HB THR 22 -9.026 3.177 6.806
147 HG1 THR 22 HG1 THR 22 -7.204 2.440 7.819
148 1HG2 THR 22 1HG2 THR 22 -8.161 3.794 4.248
149 2HG2 THR 22 2HG2 THR 22 -6.862 2.713 4.804
150 3HG2 THR 22 3HG2 THR 22 -8.549 2.146 4.794
151 H PHE 23 H PHE 23 -9.242 6.882 7.789
152 HA PHE 23 HA PHE 23 -11.439 6.926 5.863
153 1HB PHE 23 1HB PHE 23 -12.537 8.178 7.818
154 2HB PHE 23 2HB PHE 23 -12.045 6.545 8.221
155 HD1 PHE 23 HD1 PHE 23 -10.642 10.008 8.284
156 HD2 PHE 23 HD2 PHE 23 -10.906 6.231 10.198
157 HE1 PHE 23 HE1 PHE 23 -9.292 10.889 10.209
158 HE2 PHE 23 HE2 PHE 23 -9.556 7.111 12.123
159 HZ PHE 23 HZ PHE 23 -8.766 9.429 12.105
Start of MODEL 23
1 H GLU 1 H GLU 1 0.055 -11.601 15.337
2 HA GLU 1 HA GLU 1 -0.742 -13.746 14.651
3 1HB GLU 1 1HB GLU 1 -1.773 -12.362 17.082
4 2HB GLU 1 2HB GLU 1 -2.601 -13.852 16.673
5 1HG GLU 1 1HG GLU 1 -0.446 -15.077 16.628
6 2HG GLU 1 2HG GLU 1 0.433 -13.591 16.928
7 H ASN 2 H ASN 2 -3.492 -11.443 15.282
8 HA ASN 2 HA ASN 2 -4.860 -12.762 13.080
9 1HB ASN 2 1HB ASN 2 -5.654 -12.709 15.880
10 2HB ASN 2 2HB ASN 2 -6.822 -11.786 14.954
11 1HD2 ASN 2 2HD2 ASN 2 -7.323 -14.223 16.267
12 2HD2 ASN 2 1HD2 ASN 2 -7.749 -15.429 15.098
13 H PHE 3 H PHE 3 -3.277 -10.113 13.827
14 HA PHE 3 HA PHE 3 -5.402 -8.212 13.153
15 1HB PHE 3 1HB PHE 3 -2.780 -8.221 14.663
16 2HB PHE 3 2HB PHE 3 -3.152 -6.745 13.796
17 HD1 PHE 3 HD1 PHE 3 -5.174 -5.436 14.396
18 HD2 PHE 3 HD2 PHE 3 -3.956 -8.813 16.658
19 HE1 PHE 3 HE1 PHE 3 -6.631 -4.688 16.297
20 HE2 PHE 3 HE2 PHE 3 -5.413 -8.064 18.561
21 HZ PHE 3 HZ PHE 3 -6.733 -6.011 18.357
22 H ASN 4 H ASN 4 -4.469 -6.246 11.816
23 HA ASN 4 HA ASN 4 -3.161 -7.474 9.541
24 1HB ASN 4 1HB ASN 4 -3.912 -5.255 8.411
25 2HB ASN 4 2HB ASN 4 -5.185 -6.365 8.882
26 1HD2 ASN 4 2HD2 ASN 4 -6.351 -5.998 10.825
27 2HD2 ASN 4 1HD2 ASN 4 -6.527 -4.408 11.489
28 H GLY 5 H GLY 5 -1.275 -7.148 11.436
29 1HA GLY 5 1HA GLY 5 0.885 -6.173 11.101
30 2HA GLY 5 2HA GLY 5 0.117 -4.653 10.687
31 H GLY 6 H GLY 6 -1.910 -4.601 12.767
32 1HA GLY 6 1HA GLY 6 -1.689 -4.973 15.259
33 2HA GLY 6 2HA GLY 6 -0.161 -4.132 15.101
34 H CYS 7 H CYS 7 -3.507 -3.633 13.748
35 HA CYS 7 HA CYS 7 -3.265 -0.856 14.649
36 1HB CYS 7 1HB CYS 7 -4.670 -2.065 12.274
37 2HB CYS 7 2HB CYS 7 -5.093 -0.479 12.885
38 H LEU 8 H LEU 8 -5.805 0.018 14.772
39 HA LEU 8 HA LEU 8 -6.922 -1.589 16.882
40 1HB LEU 8 1HB LEU 8 -6.773 0.754 17.241
41 2HB LEU 8 2HB LEU 8 -7.570 1.115 15.722
42 HG LEU 8 HG LEU 8 -9.674 0.162 16.590
43 1HD1 LEU 8 1HD1 LEU 8 -8.039 -1.093 18.466
44 2HD1 LEU 8 2HD1 LEU 8 -8.949 0.117 19.402
45 3HD1 LEU 8 3HD1 LEU 8 -9.819 -1.087 18.422
46 1HD2 LEU 8 1HD2 LEU 8 -8.406 2.584 17.385
47 2HD2 LEU 8 2HD2 LEU 8 -10.142 2.244 17.186
48 3HD2 LEU 8 3HD2 LEU 8 -9.358 1.982 18.762
49 H ALA 9 H ALA 9 -8.062 -0.252 13.701
50 HA ALA 9 HA ALA 9 -9.107 -2.451 12.621
51 1HB ALA 9 1HB ALA 9 -10.689 -1.667 14.986
52 2HB ALA 9 2HB ALA 9 -11.658 -1.859 13.506
53 3HB ALA 9 3HB ALA 9 -10.654 -3.207 14.093
54 H GLY 10 H GLY 10 -8.661 -1.278 10.748
55 1HA GLY 10 1HA GLY 10 -10.070 -0.159 9.072
56 2HA GLY 10 2HA GLY 10 -10.412 1.063 10.282
57 H TYR 11 H TYR 11 -7.735 1.198 11.462
58 HA TYR 11 HA TYR 11 -6.603 3.127 9.813
59 1HB TYR 11 1HB TYR 11 -5.512 1.277 12.023
60 2HB TYR 11 2HB TYR 11 -4.633 2.679 11.448
61 HD1 TYR 11 HD1 TYR 11 -5.749 4.988 11.703
62 HD2 TYR 11 HD2 TYR 11 -7.125 1.482 13.732
63 HE1 TYR 11 HE1 TYR 11 -6.973 6.438 13.396
64 HE2 TYR 11 HE2 TYR 11 -8.343 2.944 15.419
65 HH TYR 11 HH TYR 11 -8.756 4.952 16.088
66 H MET 12 H MET 12 -4.524 3.144 8.684
67 HA MET 12 HA MET 12 -3.954 0.505 7.575
68 1HB MET 12 1HB MET 12 -2.992 2.001 5.637
69 2HB MET 12 2HB MET 12 -4.735 1.888 5.784
70 1HG MET 12 1HG MET 12 -4.836 4.036 6.977
71 2HG MET 12 2HG MET 12 -3.087 4.124 7.059
72 1HE MET 12 1HE MET 12 -3.824 6.372 6.405
73 2HE MET 12 2HE MET 12 -2.512 6.481 5.206
74 3HE MET 12 3HE MET 12 -4.174 6.928 4.750
75 H ARG 13 H ARG 13 -1.624 0.209 6.807
76 HA ARG 13 HA ARG 13 0.086 1.397 8.823
77 1HB ARG 13 1HB ARG 13 0.404 -1.096 7.081
78 2HB ARG 13 2HB ARG 13 1.666 -0.510 8.146
79 1HG ARG 13 1HG ARG 13 -1.046 -0.830 9.383
80 2HG ARG 13 2HG ARG 13 -0.238 -2.314 8.917
81 1HD ARG 13 1HD ARG 13 1.706 -0.611 10.217
82 2HD ARG 13 2HD ARG 13 0.272 -0.661 11.223
83 HE ARG 13 HE ARG 13 0.593 -2.983 11.573
84 1HH1 ARG 13 1HH1 ARG 13 2.842 -1.769 9.154
85 2HH1 ARG 13 2HH1 ARG 13 3.822 -3.198 9.163
86 1HH2 ARG 13 1HH2 ARG 13 1.885 -4.868 11.585
87 2HH2 ARG 13 2HH2 ARG 13 3.274 -4.972 10.555
88 H THR 14 H THR 14 1.036 3.268 8.027
89 HA THR 14 HA THR 14 1.474 3.728 5.283
90 HB THR 14 HB THR 14 2.484 5.785 6.101
91 HG1 THR 14 HG1 THR 14 2.582 4.289 8.626
92 1HG2 THR 14 1HG2 THR 14 -0.024 5.069 6.965
93 2HG2 THR 14 2HG2 THR 14 0.804 5.269 8.528
94 3HG2 THR 14 3HG2 THR 14 0.737 6.625 7.375
95 H ALA 15 H ALA 15 4.099 4.783 5.175
96 HA ALA 15 HA ALA 15 5.516 2.274 4.840
97 1HB ALA 15 1HB ALA 15 5.261 4.456 3.250
98 2HB ALA 15 2HB ALA 15 6.756 4.888 4.116
99 3HB ALA 15 3HB ALA 15 6.669 3.367 3.194
100 H ASP 16 H ASP 16 4.916 4.008 7.471
101 HA ASP 16 HA ASP 16 7.703 4.027 8.326
102 1HB ASP 16 1HB ASP 16 5.328 5.743 8.937
103 2HB ASP 16 2HB ASP 16 6.354 5.373 10.308
104 H GLY 17 H GLY 17 4.517 2.625 8.631
105 1HA GLY 17 1HA GLY 17 4.138 0.594 9.717
106 2HA GLY 17 2HA GLY 17 5.450 0.923 10.830
107 H ARG 18 H ARG 18 3.769 3.825 10.462
108 HA ARG 18 HA ARG 18 2.556 3.437 13.017
109 1HB ARG 18 1HB ARG 18 2.572 5.904 11.206
110 2HB ARG 18 2HB ARG 18 2.101 5.884 12.894
111 1HG ARG 18 1HG ARG 18 4.472 4.942 13.383
112 2HG ARG 18 2HG ARG 18 4.872 5.379 11.734
113 1HD ARG 18 1HD ARG 18 3.514 7.551 13.245
114 2HD ARG 18 2HD ARG 18 5.059 7.081 13.925
115 HE ARG 18 HE ARG 18 5.332 7.340 11.077
116 1HH1 ARG 18 1HH1 ARG 18 4.905 9.307 13.964
117 2HH1 ARG 18 2HH1 ARG 18 5.683 10.698 13.287
118 1HH2 ARG 18 1HH2 ARG 18 6.359 9.176 10.183
119 2HH2 ARG 18 2HH2 ARG 18 6.516 10.623 11.122
120 H CYS 19 H CYS 19 0.501 2.587 13.155
121 HA CYS 19 HA CYS 19 -1.168 2.216 11.012
122 1HB CYS 19 1HB CYS 19 -1.755 2.384 13.969
123 2HB CYS 19 2HB CYS 19 -2.971 1.955 12.781
124 H LYS 20 H LYS 20 -1.760 3.938 9.695
125 HA LYS 20 HA LYS 20 -2.588 6.411 11.002
126 1HB LYS 20 1HB LYS 20 -1.374 5.687 8.420
127 2HB LYS 20 2HB LYS 20 -2.670 6.858 8.283
128 1HG LYS 20 1HG LYS 20 -1.406 7.951 10.407
129 2HG LYS 20 2HG LYS 20 -0.036 7.097 9.725
130 1HD LYS 20 1HD LYS 20 -0.741 8.189 7.450
131 2HD LYS 20 2HD LYS 20 -1.732 9.259 8.422
132 1HE LYS 20 1HE LYS 20 0.357 9.825 9.783
133 2HE LYS 20 2HE LYS 20 1.294 8.898 8.628
134 1HZ LYS 20 1HZ LYS 20 -0.436 10.751 7.362
135 2HZ LYS 20 2HZ LYS 20 0.603 11.492 8.381
136 3HZ LYS 20 3HZ LYS 20 1.174 10.544 7.180
137 HA PRO 21 HA PRO 21 -6.761 5.818 10.060
138 1HB PRO 21 1HB PRO 21 -7.654 8.264 9.228
139 2HB PRO 21 2HB PRO 21 -7.382 7.866 10.913
140 1HG PRO 21 1HG PRO 21 -5.736 9.537 9.114
141 2HG PRO 21 2HG PRO 21 -5.726 9.470 10.865
142 1HD PRO 21 1HD PRO 21 -3.803 8.293 9.093
143 2HD PRO 21 2HD PRO 21 -3.859 8.130 10.836
144 H THR 22 H THR 22 -8.269 5.090 8.585
145 HA THR 22 HA THR 22 -7.339 5.446 5.812
146 HB THR 22 HB THR 22 -8.935 3.084 6.894
147 HG1 THR 22 HG1 THR 22 -6.824 2.180 7.331
148 1HG2 THR 22 1HG2 THR 22 -7.782 3.825 4.335
149 2HG2 THR 22 2HG2 THR 22 -6.886 2.429 4.983
150 3HG2 THR 22 3HG2 THR 22 -8.649 2.329 4.759
151 H PHE 23 H PHE 23 -9.450 6.761 7.866
152 HA PHE 23 HA PHE 23 -11.747 6.533 6.084
153 1HB PHE 23 1HB PHE 23 -12.820 7.796 8.047
154 2HB PHE 23 2HB PHE 23 -12.156 6.238 8.496
155 HD1 PHE 23 HD1 PHE 23 -11.272 9.855 8.407
156 HD2 PHE 23 HD2 PHE 23 -10.661 6.091 10.270
157 HE1 PHE 23 HE1 PHE 23 -9.880 10.958 10.181
158 HE2 PHE 23 HE2 PHE 23 -9.269 7.195 12.044
159 HZ PHE 23 HZ PHE 23 -8.896 9.616 11.978
Start of MODEL 24
1 H GLU 1 H GLU 1 -5.462 -11.428 2.332
2 HA GLU 1 HA GLU 1 -6.944 -9.558 2.211
3 1HB GLU 1 1HB GLU 1 -7.023 -11.464 4.523
4 2HB GLU 1 2HB GLU 1 -8.148 -10.122 4.580
5 1HG GLU 1 1HG GLU 1 -8.102 -11.293 1.898
6 2HG GLU 1 2HG GLU 1 -8.424 -12.530 3.096
7 H ASN 2 H ASN 2 -4.921 -7.927 2.532
8 HA ASN 2 HA ASN 2 -4.193 -6.094 3.430
9 1HB ASN 2 1HB ASN 2 -6.970 -6.193 4.674
10 2HB ASN 2 2HB ASN 2 -5.873 -4.894 5.096
11 1HD2 ASN 2 2HD2 ASN 2 -6.356 -3.137 4.039
12 2HD2 ASN 2 1HD2 ASN 2 -6.780 -2.995 2.365
13 H PHE 3 H PHE 3 -3.663 -4.965 5.712
14 HA PHE 3 HA PHE 3 -2.839 -7.120 7.474
15 1HB PHE 3 1HB PHE 3 -1.911 -4.509 6.565
16 2HB PHE 3 2HB PHE 3 -2.091 -4.427 8.306
17 HD1 PHE 3 HD1 PHE 3 -0.940 -6.281 9.688
18 HD2 PHE 3 HD2 PHE 3 0.004 -5.459 5.633
19 HE1 PHE 3 HE1 PHE 3 1.277 -7.424 9.972
20 HE2 PHE 3 HE2 PHE 3 2.221 -6.603 5.918
21 HZ PHE 3 HZ PHE 3 2.831 -7.572 8.083
22 H ASN 4 H ASN 4 -2.955 -6.709 9.900
23 HA ASN 4 HA ASN 4 -4.593 -4.855 11.020
24 1HB ASN 4 1HB ASN 4 -6.205 -6.583 9.540
25 2HB ASN 4 2HB ASN 4 -6.249 -7.335 11.122
26 1HD2 ASN 4 2HD2 ASN 4 -6.341 -5.552 12.952
27 2HD2 ASN 4 1HD2 ASN 4 -7.626 -4.402 12.783
28 H GLY 5 H GLY 5 -2.154 -6.251 11.557
29 1HA GLY 5 1HA GLY 5 -2.868 -7.976 13.853
30 2HA GLY 5 2HA GLY 5 -1.421 -8.153 12.880
31 H GLY 6 H GLY 6 -2.898 -5.059 14.014
32 1HA GLY 6 1HA GLY 6 -1.220 -4.692 16.249
33 2HA GLY 6 2HA GLY 6 -0.473 -3.951 14.848
34 H CYS 7 H CYS 7 -2.559 -2.936 13.355
35 HA CYS 7 HA CYS 7 -3.143 -0.585 14.629
36 1HB CYS 7 1HB CYS 7 -4.550 -1.954 12.332
37 2HB CYS 7 2HB CYS 7 -4.912 -0.321 12.852
38 H LEU 8 H LEU 8 -5.758 0.076 14.695
39 HA LEU 8 HA LEU 8 -6.759 -1.578 16.842
40 1HB LEU 8 1HB LEU 8 -6.736 0.772 17.206
41 2HB LEU 8 2HB LEU 8 -7.561 1.090 15.694
42 HG LEU 8 HG LEU 8 -9.592 -0.035 16.589
43 1HD1 LEU 8 1HD1 LEU 8 -8.067 -1.312 18.335
44 2HD1 LEU 8 2HD1 LEU 8 -8.485 0.082 19.360
45 3HD1 LEU 8 3HD1 LEU 8 -9.773 -0.940 18.678
46 1HD2 LEU 8 1HD2 LEU 8 -8.789 2.514 16.929
47 2HD2 LEU 8 2HD2 LEU 8 -10.363 1.892 17.480
48 3HD2 LEU 8 3HD2 LEU 8 -9.013 2.037 18.630
49 H ALA 9 H ALA 9 -7.991 -0.278 13.679
50 HA ALA 9 HA ALA 9 -8.905 -2.518 12.570
51 1HB ALA 9 1HB ALA 9 -10.574 -1.814 14.928
52 2HB ALA 9 2HB ALA 9 -11.470 -2.195 13.438
53 3HB ALA 9 3HB ALA 9 -10.334 -3.383 14.122
54 H GLY 10 H GLY 10 -8.578 -1.307 10.704
55 1HA GLY 10 1HA GLY 10 -10.088 -0.245 9.074
56 2HA GLY 10 2HA GLY 10 -10.459 0.944 10.307
57 H TYR 11 H TYR 11 -7.678 1.062 11.390
58 HA TYR 11 HA TYR 11 -6.703 3.096 9.710
59 1HB TYR 11 1HB TYR 11 -5.528 1.351 11.962
60 2HB TYR 11 2HB TYR 11 -4.699 2.764 11.340
61 HD1 TYR 11 HD1 TYR 11 -7.629 1.596 13.262
62 HD2 TYR 11 HD2 TYR 11 -5.402 5.001 11.940
63 HE1 TYR 11 HE1 TYR 11 -8.888 3.067 14.911
64 HE2 TYR 11 HE2 TYR 11 -6.668 6.461 13.593
65 HH TYR 11 HH TYR 11 -8.362 6.567 14.967
66 H MET 12 H MET 12 -4.541 3.175 8.669
67 HA MET 12 HA MET 12 -3.907 0.555 7.551
68 1HB MET 12 1HB MET 12 -3.031 1.957 5.578
69 2HB MET 12 2HB MET 12 -4.765 2.033 5.814
70 1HG MET 12 1HG MET 12 -4.619 4.204 6.895
71 2HG MET 12 2HG MET 12 -2.876 4.090 7.041
72 1HE MET 12 1HE MET 12 -2.304 6.003 6.262
73 2HE MET 12 2HE MET 12 -1.952 6.343 4.552
74 3HE MET 12 3HE MET 12 -3.472 6.917 5.278
75 H ARG 13 H ARG 13 -1.561 0.296 6.840
76 HA ARG 13 HA ARG 13 0.090 1.555 8.863
77 1HB ARG 13 1HB ARG 13 -0.175 -1.100 8.253
78 2HB ARG 13 2HB ARG 13 1.155 -0.699 7.185
79 1HG ARG 13 1HG ARG 13 2.542 -0.914 8.968
80 2HG ARG 13 2HG ARG 13 1.848 0.565 9.603
81 1HD ARG 13 1HD ARG 13 1.556 -1.025 11.360
82 2HD ARG 13 2HD ARG 13 -0.026 -0.912 10.615
83 HE ARG 13 HE ARG 13 0.166 -3.155 10.017
84 1HH1 ARG 13 1HH1 ARG 13 3.401 -1.833 10.429
85 2HH1 ARG 13 2HH1 ARG 13 4.193 -3.349 10.156
86 1HH2 ARG 13 1HH2 ARG 13 1.211 -5.155 9.656
87 2HH2 ARG 13 2HH2 ARG 13 2.939 -5.251 9.713
88 H THR 14 H THR 14 1.096 3.391 8.076
89 HA THR 14 HA THR 14 1.491 3.915 5.360
90 HB THR 14 HB THR 14 2.691 5.862 6.216
91 HG1 THR 14 HG1 THR 14 2.841 4.091 8.551
92 1HG2 THR 14 1HG2 THR 14 0.178 5.108 7.300
93 2HG2 THR 14 2HG2 THR 14 1.156 5.596 8.704
94 3HG2 THR 14 3HG2 THR 14 0.908 6.730 7.356
95 H ALA 15 H ALA 15 4.302 4.858 5.524
96 HA ALA 15 HA ALA 15 5.490 2.292 4.813
97 1HB ALA 15 1HB ALA 15 5.451 4.282 3.238
98 2HB ALA 15 2HB ALA 15 6.558 5.104 4.364
99 3HB ALA 15 3HB ALA 15 7.066 3.603 3.552
100 H ASP 16 H ASP 16 5.060 3.938 7.596
101 HA ASP 16 HA ASP 16 7.804 3.454 8.454
102 1HB ASP 16 1HB ASP 16 6.246 5.772 8.698
103 2HB ASP 16 2HB ASP 16 6.072 5.021 10.272
104 H GLY 17 H GLY 17 4.527 2.437 8.547
105 1HA GLY 17 1HA GLY 17 3.838 0.472 9.595
106 2HA GLY 17 2HA GLY 17 5.074 0.673 10.822
107 H ARG 18 H ARG 18 3.897 3.751 10.473
108 HA ARG 18 HA ARG 18 2.518 3.611 12.896
109 1HB ARG 18 1HB ARG 18 2.512 5.867 10.828
110 2HB ARG 18 2HB ARG 18 2.086 6.030 12.520
111 1HG ARG 18 1HG ARG 18 4.311 5.770 13.255
112 2HG ARG 18 2HG ARG 18 4.795 4.884 11.822
113 1HD ARG 18 1HD ARG 18 5.647 6.843 11.034
114 2HD ARG 18 2HD ARG 18 3.993 7.367 10.785
115 HE ARG 18 HE ARG 18 4.123 8.706 12.727
116 1HH1 ARG 18 1HH1 ARG 18 6.940 6.609 12.502
117 2HH1 ARG 18 2HH1 ARG 18 7.807 7.425 13.760
118 1HH2 ARG 18 1HH2 ARG 18 5.267 9.784 14.386
119 2HH2 ARG 18 2HH2 ARG 18 6.849 9.244 14.838
120 H CYS 19 H CYS 19 0.463 2.785 13.141
121 HA CYS 19 HA CYS 19 -1.231 2.309 10.987
122 1HB CYS 19 1HB CYS 19 -1.758 2.424 13.961
123 2HB CYS 19 2HB CYS 19 -2.963 1.935 12.786
124 H LYS 20 H LYS 20 -1.836 4.079 9.725
125 HA LYS 20 HA LYS 20 -2.781 6.457 11.134
126 1HB LYS 20 1HB LYS 20 -1.188 6.051 8.830
127 2HB LYS 20 2HB LYS 20 -2.707 6.714 8.260
128 1HG LYS 20 1HG LYS 20 -1.790 8.731 8.834
129 2HG LYS 20 2HG LYS 20 -2.288 8.305 10.459
130 1HD LYS 20 1HD LYS 20 -0.132 7.840 11.156
131 2HD LYS 20 2HD LYS 20 0.345 7.176 9.606
132 1HE LYS 20 1HE LYS 20 1.399 9.131 9.144
133 2HE LYS 20 2HE LYS 20 -0.164 9.921 9.091
134 1HZ LYS 20 1HZ LYS 20 0.233 9.795 11.694
135 2HZ LYS 20 2HZ LYS 20 1.786 9.898 11.199
136 3HZ LYS 20 3HZ LYS 20 0.717 11.059 10.780
137 HA PRO 21 HA PRO 21 -6.893 5.711 10.049
138 1HB PRO 21 1HB PRO 21 -7.898 8.188 9.481
139 2HB PRO 21 2HB PRO 21 -7.641 7.609 11.116
140 1HG PRO 21 1HG PRO 21 -6.049 9.562 9.569
141 2HG PRO 21 2HG PRO 21 -6.074 9.291 11.300
142 1HD PRO 21 1HD PRO 21 -4.052 8.430 9.458
143 2HD PRO 21 2HD PRO 21 -4.137 8.061 11.168
144 H THR 22 H THR 22 -8.280 5.028 8.458
145 HA THR 22 HA THR 22 -7.578 6.018 5.784
146 HB THR 22 HB THR 22 -7.382 3.245 6.915
147 HG1 THR 22 HG1 THR 22 -5.891 3.386 4.906
148 1HG2 THR 22 1HG2 THR 22 -8.464 3.884 4.122
149 2HG2 THR 22 2HG2 THR 22 -7.709 2.331 4.556
150 3HG2 THR 22 3HG2 THR 22 -9.223 2.836 5.345
151 H PHE 23 H PHE 23 -9.839 6.006 8.110
152 HA PHE 23 HA PHE 23 -12.059 5.177 6.449
153 1HB PHE 23 1HB PHE 23 -13.297 5.920 8.587
154 2HB PHE 23 2HB PHE 23 -12.112 4.657 8.849
155 HD1 PHE 23 HD1 PHE 23 -12.430 8.371 8.941
156 HD2 PHE 23 HD2 PHE 23 -10.532 4.921 10.523
157 HE1 PHE 23 HE1 PHE 23 -11.304 9.788 10.679
158 HE2 PHE 23 HE2 PHE 23 -9.405 6.339 12.262
159 HZ PHE 23 HZ PHE 23 -9.805 8.755 12.320
Start of MODEL 25
1 H GLU 1 H GLU 1 -1.041 -12.629 4.040
2 HA GLU 1 HA GLU 1 -2.010 -11.723 2.054
3 1HB GLU 1 1HB GLU 1 -2.846 -13.915 3.103
4 2HB GLU 1 2HB GLU 1 -4.208 -13.004 3.726
5 1HG GLU 1 1HG GLU 1 -4.730 -12.261 1.356
6 2HG GLU 1 2HG GLU 1 -3.442 -13.303 0.784
7 H ASN 2 H ASN 2 -4.183 -11.139 4.920
8 HA ASN 2 HA ASN 2 -5.279 -8.891 3.471
9 1HB ASN 2 1HB ASN 2 -6.202 -10.722 5.619
10 2HB ASN 2 2HB ASN 2 -6.594 -9.046 5.948
11 1HD2 ASN 2 2HD2 ASN 2 -7.852 -11.724 4.778
12 2HD2 ASN 2 1HD2 ASN 2 -8.924 -11.142 3.547
13 H PHE 3 H PHE 3 -5.666 -6.821 4.858
14 HA PHE 3 HA PHE 3 -3.325 -6.416 6.574
15 1HB PHE 3 1HB PHE 3 -4.543 -5.036 4.338
16 2HB PHE 3 2HB PHE 3 -4.802 -4.019 5.741
17 HD1 PHE 3 HD1 PHE 3 -2.071 -5.921 4.051
18 HD2 PHE 3 HD2 PHE 3 -3.151 -2.518 6.344
19 HE1 PHE 3 HE1 PHE 3 0.270 -5.041 3.846
20 HE2 PHE 3 HE2 PHE 3 -0.809 -1.637 6.140
21 HZ PHE 3 HZ PHE 3 0.873 -2.910 4.893
22 H ASN 4 H ASN 4 -4.036 -6.900 8.648
23 HA ASN 4 HA ASN 4 -5.446 -5.036 10.014
24 1HB ASN 4 1HB ASN 4 -7.283 -6.460 8.474
25 2HB ASN 4 2HB ASN 4 -7.328 -7.351 9.983
26 1HD2 ASN 4 2HD2 ASN 4 -7.218 -5.796 11.978
27 2HD2 ASN 4 1HD2 ASN 4 -8.373 -4.506 11.977
28 H GLY 5 H GLY 5 -3.130 -6.682 10.299
29 1HA GLY 5 1HA GLY 5 -3.898 -8.450 12.546
30 2HA GLY 5 2HA GLY 5 -2.630 -8.840 11.400
31 H GLY 6 H GLY 6 -3.395 -5.611 12.836
32 1HA GLY 6 1HA GLY 6 -1.286 -5.717 14.757
33 2HA GLY 6 2HA GLY 6 -0.797 -4.848 13.315
34 H CYS 7 H CYS 7 -2.876 -3.385 12.451
35 HA CYS 7 HA CYS 7 -3.007 -1.285 14.213
36 1HB CYS 7 1HB CYS 7 -4.643 -2.058 11.814
37 2HB CYS 7 2HB CYS 7 -5.063 -0.641 12.756
38 H LEU 8 H LEU 8 -5.608 -0.447 14.610
39 HA LEU 8 HA LEU 8 -6.563 -2.455 16.500
40 1HB LEU 8 1HB LEU 8 -6.091 -0.361 17.493
41 2HB LEU 8 2HB LEU 8 -6.945 0.520 16.242
42 HG LEU 8 HG LEU 8 -9.089 -0.414 17.036
43 1HD1 LEU 8 1HD1 LEU 8 -7.434 -2.281 18.363
44 2HD1 LEU 8 2HD1 LEU 8 -8.270 -1.347 19.627
45 3HD1 LEU 8 3HD1 LEU 8 -9.211 -2.182 18.368
46 1HD2 LEU 8 1HD2 LEU 8 -7.342 1.130 18.946
47 2HD2 LEU 8 2HD2 LEU 8 -8.640 1.716 17.878
48 3HD2 LEU 8 3HD2 LEU 8 -9.041 0.760 19.325
49 H ALA 9 H ALA 9 -7.802 -0.183 13.952
50 HA ALA 9 HA ALA 9 -9.267 -1.918 12.526
51 1HB ALA 9 1HB ALA 9 -10.464 -1.541 15.173
52 2HB ALA 9 2HB ALA 9 -11.583 -1.104 13.859
53 3HB ALA 9 3HB ALA 9 -10.855 -2.728 13.906
54 H GLY 10 H GLY 10 -9.483 -0.687 10.733
55 1HA GLY 10 1HA GLY 10 -10.433 1.026 9.508
56 2HA GLY 10 2HA GLY 10 -10.721 1.943 10.973
57 H TYR 11 H TYR 11 -7.556 0.528 10.865
58 HA TYR 11 HA TYR 11 -6.451 3.056 9.844
59 1HB TYR 11 1HB TYR 11 -5.419 1.199 12.074
60 2HB TYR 11 2HB TYR 11 -4.741 2.761 11.656
61 HD1 TYR 11 HD1 TYR 11 -6.857 4.641 11.580
62 HD2 TYR 11 HD2 TYR 11 -6.478 1.226 14.130
63 HE1 TYR 11 HE1 TYR 11 -8.365 5.748 13.300
64 HE2 TYR 11 HE2 TYR 11 -7.987 2.346 15.842
65 HH TYR 11 HH TYR 11 -8.509 4.930 16.363
66 H MET 12 H MET 12 -4.431 2.910 8.719
67 HA MET 12 HA MET 12 -3.809 0.166 7.934
68 1HB MET 12 1HB MET 12 -2.920 1.490 5.793
69 2HB MET 12 2HB MET 12 -4.632 1.149 5.944
70 1HG MET 12 1HG MET 12 -5.166 3.374 6.541
71 2HG MET 12 2HG MET 12 -3.553 3.715 7.135
72 1HE MET 12 1HE MET 12 -3.840 5.825 6.104
73 2HE MET 12 2HE MET 12 -3.286 6.203 4.455
74 3HE MET 12 3HE MET 12 -5.003 5.838 4.755
75 H ARG 13 H ARG 13 -1.501 -0.213 7.281
76 HA ARG 13 HA ARG 13 0.184 1.321 9.044
77 1HB ARG 13 1HB ARG 13 0.618 -1.296 7.523
78 2HB ARG 13 2HB ARG 13 1.868 -0.542 8.492
79 1HG ARG 13 1HG ARG 13 -0.546 -0.650 10.079
80 2HG ARG 13 2HG ARG 13 -0.292 -2.234 9.374
81 1HD ARG 13 1HD ARG 13 2.286 -1.512 10.196
82 2HD ARG 13 2HD ARG 13 1.277 -0.836 11.460
83 HE ARG 13 HE ARG 13 0.282 -3.429 11.028
84 1HH1 ARG 13 1HH1 ARG 13 3.346 -2.001 12.004
85 2HH1 ARG 13 2HH1 ARG 13 3.826 -3.366 12.955
86 1HH2 ARG 13 1HH2 ARG 13 0.915 -5.232 12.282
87 2HH2 ARG 13 2HH2 ARG 13 2.434 -5.217 13.114
88 H THR 14 H THR 14 0.943 3.185 8.040
89 HA THR 14 HA THR 14 1.295 3.459 5.282
90 HB THR 14 HB THR 14 2.311 5.588 5.925
91 HG1 THR 14 HG1 THR 14 3.339 5.704 7.951
92 1HG2 THR 14 1HG2 THR 14 -0.120 4.678 7.148
93 2HG2 THR 14 2HG2 THR 14 0.800 5.529 8.411
94 3HG2 THR 14 3HG2 THR 14 0.393 6.363 6.893
95 H ALA 15 H ALA 15 4.003 4.680 5.333
96 HA ALA 15 HA ALA 15 5.450 2.165 4.960
97 1HB ALA 15 1HB ALA 15 5.160 3.809 3.061
98 2HB ALA 15 2HB ALA 15 6.145 4.963 3.991
99 3HB ALA 15 3HB ALA 15 6.853 3.421 3.450
100 H ASP 16 H ASP 16 4.862 4.064 7.488
101 HA ASP 16 HA ASP 16 7.668 4.213 8.261
102 1HB ASP 16 1HB ASP 16 6.392 6.379 8.267
103 2HB ASP 16 2HB ASP 16 5.247 5.689 9.401
104 H GLY 17 H GLY 17 4.568 2.702 8.714
105 1HA GLY 17 1HA GLY 17 4.317 0.736 9.956
106 2HA GLY 17 2HA GLY 17 5.585 1.247 11.051
107 H ARG 18 H ARG 18 3.685 3.969 10.383
108 HA ARG 18 HA ARG 18 2.472 3.726 12.962
109 1HB ARG 18 1HB ARG 18 1.999 6.096 12.754
110 2HB ARG 18 2HB ARG 18 3.608 5.847 12.107
111 1HG ARG 18 1HG ARG 18 2.234 5.503 9.809
112 2HG ARG 18 2HG ARG 18 1.051 6.487 10.648
113 1HD ARG 18 1HD ARG 18 3.014 8.119 11.164
114 2HD ARG 18 2HD ARG 18 3.933 7.215 9.978
115 HE ARG 18 HE ARG 18 1.284 8.115 9.049
116 1HH1 ARG 18 2HH1 ARG 18 4.722 8.840 9.245
117 2HH1 ARG 18 1HH1 ARG 18 4.691 9.959 7.924
118 1HH2 ARG 18 1HH2 ARG 18 1.243 9.592 7.306
119 2HH2 ARG 18 2HH2 ARG 18 2.699 10.390 6.813
120 H CYS 19 H CYS 19 0.415 2.916 13.226
121 HA CYS 19 HA CYS 19 -1.185 2.314 10.996
122 1HB CYS 19 1HB CYS 19 -1.578 2.189 13.970
123 2HB CYS 19 2HB CYS 19 -2.929 1.914 12.889
124 H LYS 20 H LYS 20 -1.897 4.082 9.782
125 HA LYS 20 HA LYS 20 -3.097 6.296 11.279
126 1HB LYS 20 1HB LYS 20 -1.536 6.080 8.783
127 2HB LYS 20 2HB LYS 20 -2.931 7.134 8.673
128 1HG LYS 20 1HG LYS 20 -1.587 7.600 11.209
129 2HG LYS 20 2HG LYS 20 -0.410 7.687 9.914
130 1HD LYS 20 1HD LYS 20 -2.296 9.161 8.719
131 2HD LYS 20 2HD LYS 20 -2.868 9.390 10.360
132 1HE LYS 20 1HE LYS 20 -0.559 10.167 11.024
133 2HE LYS 20 2HE LYS 20 -0.047 10.006 9.356
134 1HZ LYS 20 1HZ LYS 20 -2.315 11.684 10.165
135 2HZ LYS 20 2HZ LYS 20 -0.790 12.252 10.025
136 3HZ LYS 20 3HZ LYS 20 -1.567 11.663 8.714
137 HA PRO 21 HA PRO 21 -7.019 5.347 9.742
138 1HB PRO 21 1HB PRO 21 -8.142 7.766 9.144
139 2HB PRO 21 2HB PRO 21 -8.005 7.151 10.779
140 1HG PRO 21 1HG PRO 21 -6.417 9.262 9.453
141 2HG PRO 21 2HG PRO 21 -6.590 8.932 11.165
142 1HD PRO 21 1HD PRO 21 -4.340 8.277 9.510
143 2HD PRO 21 2HD PRO 21 -4.565 7.845 11.193
144 H THR 22 H THR 22 -8.209 4.641 8.002
145 HA THR 22 HA THR 22 -6.812 5.030 5.502
146 HB THR 22 HB THR 22 -9.406 3.500 5.887
147 HG1 THR 22 HG1 THR 22 -8.123 1.901 6.965
148 1HG2 THR 22 1HG2 THR 22 -7.010 3.441 4.097
149 2HG2 THR 22 2HG2 THR 22 -7.557 1.850 4.679
150 3HG2 THR 22 3HG2 THR 22 -8.675 2.899 3.774
151 H PHE 23 H PHE 23 -8.719 7.070 7.135
152 HA PHE 23 HA PHE 23 -10.180 7.859 4.714
153 1HB PHE 23 1HB PHE 23 -11.689 9.006 6.427
154 2HB PHE 23 2HB PHE 23 -11.650 7.264 6.617
155 HD1 PHE 23 HD1 PHE 23 -9.913 10.317 7.882
156 HD2 PHE 23 HD2 PHE 23 -11.278 6.388 8.723
157 HE1 PHE 23 HE1 PHE 23 -9.230 10.593 10.281
158 HE2 PHE 23 HE2 PHE 23 -10.594 6.665 11.123
159 HZ PHE 23 HZ PHE 23 -9.578 8.764 11.872
Start of MODEL 26
1 H GLU 1 H GLU 1 -8.227 -14.864 14.263
2 HA GLU 1 HA GLU 1 -7.370 -13.043 15.550
3 1HB GLU 1 1HB GLU 1 -5.557 -14.832 13.972
4 2HB GLU 1 2HB GLU 1 -4.789 -13.515 14.835
5 1HG GLU 1 1HG GLU 1 -5.293 -14.389 16.916
6 2HG GLU 1 2HG GLU 1 -6.838 -15.030 16.397
7 H ASN 2 H ASN 2 -8.118 -10.986 14.754
8 HA ASN 2 HA ASN 2 -7.372 -9.792 12.454
9 1HB ASN 2 1HB ASN 2 -7.684 -7.593 13.792
10 2HB ASN 2 2HB ASN 2 -9.033 -8.712 13.816
11 1HD2 ASN 2 2HD2 ASN 2 -6.694 -7.029 15.619
12 2HD2 ASN 2 1HD2 ASN 2 -7.044 -7.648 17.198
13 H PHE 3 H PHE 3 -5.482 -8.735 11.715
14 HA PHE 3 HA PHE 3 -3.571 -7.620 13.427
15 1HB PHE 3 1HB PHE 3 -3.322 -10.229 13.694
16 2HB PHE 3 2HB PHE 3 -2.764 -10.234 12.033
17 HD1 PHE 3 HD1 PHE 3 -2.035 -8.633 15.319
18 HD2 PHE 3 HD2 PHE 3 -0.502 -9.965 11.593
19 HE1 PHE 3 HE1 PHE 3 0.297 -8.136 16.102
20 HE2 PHE 3 HE2 PHE 3 1.830 -9.468 12.376
21 HZ PHE 3 HZ PHE 3 2.203 -8.560 14.621
22 H ASN 4 H ASN 4 -2.503 -6.098 12.237
23 HA ASN 4 HA ASN 4 -1.878 -6.702 9.506
24 1HB ASN 4 1HB ASN 4 -4.149 -5.726 9.296
25 2HB ASN 4 2HB ASN 4 -3.690 -4.360 10.293
26 1HD2 ASN 4 2HD2 ASN 4 -3.363 -2.595 9.200
27 2HD2 ASN 4 1HD2 ASN 4 -2.669 -2.441 7.622
28 H GLY 5 H GLY 5 -0.130 -6.432 11.665
29 1HA GLY 5 1HA GLY 5 1.946 -5.280 11.608
30 2HA GLY 5 2HA GLY 5 1.114 -3.809 11.144
31 H GLY 6 H GLY 6 -1.118 -4.009 13.025
32 1HA GLY 6 1HA GLY 6 -1.054 -4.430 15.532
33 2HA GLY 6 2HA GLY 6 0.355 -3.389 15.508
34 H CYS 7 H CYS 7 -2.863 -3.278 13.809
35 HA CYS 7 HA CYS 7 -3.054 -0.500 14.690
36 1HB CYS 7 1HB CYS 7 -4.359 -1.972 12.399
37 2HB CYS 7 2HB CYS 7 -4.831 -0.362 12.900
38 H LEU 8 H LEU 8 -5.731 -0.007 14.678
39 HA LEU 8 HA LEU 8 -6.661 -1.725 16.827
40 1HB LEU 8 1HB LEU 8 -6.691 0.606 17.284
41 2HB LEU 8 2HB LEU 8 -7.511 0.968 15.778
42 HG LEU 8 HG LEU 8 -9.533 -0.201 16.605
43 1HD1 LEU 8 1HD1 LEU 8 -7.841 -1.409 18.409
44 2HD1 LEU 8 2HD1 LEU 8 -8.715 -0.230 19.417
45 3HD1 LEU 8 3HD1 LEU 8 -9.620 -1.432 18.466
46 1HD2 LEU 8 1HD2 LEU 8 -8.399 2.116 18.162
47 2HD2 LEU 8 2HD2 LEU 8 -9.614 2.119 16.863
48 3HD2 LEU 8 3HD2 LEU 8 -10.035 1.489 18.473
49 H ALA 9 H ALA 9 -7.890 -0.353 13.695
50 HA ALA 9 HA ALA 9 -8.773 -2.590 12.538
51 1HB ALA 9 1HB ALA 9 -10.513 -1.874 14.852
52 2HB ALA 9 2HB ALA 9 -11.347 -2.308 13.340
53 3HB ALA 9 3HB ALA 9 -10.213 -3.455 14.092
54 H GLY 10 H GLY 10 -8.480 -1.429 10.655
55 1HA GLY 10 1HA GLY 10 -9.937 -0.329 9.023
56 2HA GLY 10 2HA GLY 10 -10.317 0.857 10.256
57 H TYR 11 H TYR 11 -7.693 1.190 11.420
58 HA TYR 11 HA TYR 11 -6.656 3.169 9.806
59 1HB TYR 11 1HB TYR 11 -5.454 1.297 11.936
60 2HB TYR 11 2HB TYR 11 -4.615 2.729 11.372
61 HD1 TYR 11 HD1 TYR 11 -5.880 5.003 11.628
62 HD2 TYR 11 HD2 TYR 11 -6.921 1.441 13.757
63 HE1 TYR 11 HE1 TYR 11 -7.092 6.394 13.378
64 HE2 TYR 11 HE2 TYR 11 -8.129 2.844 15.500
65 HH TYR 11 HH TYR 11 -7.670 5.671 16.168
66 H MET 12 H MET 12 -4.588 3.318 8.652
67 HA MET 12 HA MET 12 -3.997 0.777 7.355
68 1HB MET 12 1HB MET 12 -2.999 2.407 5.567
69 2HB MET 12 2HB MET 12 -4.744 2.366 5.713
70 1HG MET 12 1HG MET 12 -4.804 4.425 6.956
71 2HG MET 12 2HG MET 12 -3.087 4.364 7.304
72 1HE MET 12 1HE MET 12 -4.060 6.757 6.646
73 2HE MET 12 2HE MET 12 -2.432 6.994 5.967
74 3HE MET 12 3HE MET 12 -3.868 7.421 5.006
75 H ARG 13 H ARG 13 -1.681 0.434 6.662
76 HA ARG 13 HA ARG 13 0.030 1.468 8.760
77 1HB ARG 13 1HB ARG 13 0.138 -0.901 8.791
78 2HB ARG 13 2HB ARG 13 0.046 -1.031 7.046
79 1HG ARG 13 1HG ARG 13 2.314 -0.751 6.767
80 2HG ARG 13 2HG ARG 13 2.426 0.464 8.025
81 1HD ARG 13 1HD ARG 13 2.456 -1.214 9.778
82 2HD ARG 13 2HD ARG 13 1.982 -2.484 8.667
83 HE ARG 13 HE ARG 13 4.303 -1.661 7.514
84 1HH1 ARG 13 1HH1 ARG 13 3.537 -2.360 10.877
85 2HH1 ARG 13 2HH1 ARG 13 5.148 -2.856 11.274
86 1HH2 ARG 13 1HH2 ARG 13 6.429 -2.316 8.038
87 2HH2 ARG 13 2HH2 ARG 13 6.804 -2.830 9.648
88 H THR 14 H THR 14 1.197 3.263 8.123
89 HA THR 14 HA THR 14 1.629 3.920 5.416
90 HB THR 14 HB THR 14 2.826 5.807 6.382
91 HG1 THR 14 HG1 THR 14 2.957 3.896 8.599
92 1HG2 THR 14 1HG2 THR 14 0.329 4.912 7.574
93 2HG2 THR 14 2HG2 THR 14 1.342 5.658 8.834
94 3HG2 THR 14 3HG2 THR 14 0.918 6.579 7.371
95 H ALA 15 H ALA 15 4.427 4.780 5.613
96 HA ALA 15 HA ALA 15 5.582 2.216 4.865
97 1HB ALA 15 1HB ALA 15 6.408 5.116 4.466
98 2HB ALA 15 2HB ALA 15 7.401 3.729 3.957
99 3HB ALA 15 3HB ALA 15 5.792 3.982 3.240
100 H ASP 16 H ASP 16 5.125 3.789 7.702
101 HA ASP 16 HA ASP 16 7.792 3.061 8.631
102 1HB ASP 16 1HB ASP 16 6.492 5.555 8.813
103 2HB ASP 16 2HB ASP 16 6.259 4.852 10.401
104 H GLY 17 H GLY 17 4.556 2.197 8.506
105 1HA GLY 17 1HA GLY 17 3.630 0.388 9.612
106 2HA GLY 17 2HA GLY 17 4.767 0.583 10.931
107 H ARG 18 H ARG 18 3.982 3.698 10.538
108 HA ARG 18 HA ARG 18 2.450 3.860 12.775
109 1HB ARG 18 1HB ARG 18 2.560 5.802 10.412
110 2HB ARG 18 2HB ARG 18 1.942 6.212 12.000
111 1HG ARG 18 1HG ARG 18 4.706 5.016 11.840
112 2HG ARG 18 2HG ARG 18 4.506 6.674 11.307
113 1HD ARG 18 1HD ARG 18 4.002 7.455 13.441
114 2HD ARG 18 2HD ARG 18 3.211 5.967 13.921
115 HE ARG 18 HE ARG 18 5.242 5.246 14.801
116 1HH1 ARG 18 1HH1 ARG 18 5.899 7.627 12.295
117 2HH1 ARG 18 2HH1 ARG 18 7.611 7.620 12.559
118 1HH2 ARG 18 1HH2 ARG 18 7.501 5.237 15.149
119 2HH2 ARG 18 2HH2 ARG 18 8.528 6.252 14.193
120 H CYS 19 H CYS 19 0.389 3.092 13.127
121 HA CYS 19 HA CYS 19 -1.306 2.426 10.982
122 1HB CYS 19 1HB CYS 19 -1.798 2.616 13.958
123 2HB CYS 19 2HB CYS 19 -2.990 2.041 12.810
124 H LYS 20 H LYS 20 -1.815 4.246 9.694
125 HA LYS 20 HA LYS 20 -2.815 6.612 11.056
126 1HB LYS 20 1HB LYS 20 -1.422 6.061 8.585
127 2HB LYS 20 2HB LYS 20 -2.898 6.943 8.249
128 1HG LYS 20 1HG LYS 20 -2.172 8.846 9.323
129 2HG LYS 20 2HG LYS 20 -1.392 7.950 10.612
130 1HD LYS 20 1HD LYS 20 0.535 7.441 9.180
131 2HD LYS 20 2HD LYS 20 -0.267 8.123 7.779
132 1HE LYS 20 1HE LYS 20 0.162 10.303 8.414
133 2HE LYS 20 2HE LYS 20 -0.058 9.966 10.120
134 1HZ LYS 20 1HZ LYS 20 2.175 8.574 9.277
135 2HZ LYS 20 2HZ LYS 20 2.320 10.092 8.691
136 3HZ LYS 20 3HZ LYS 20 2.116 9.851 10.293
137 HA PRO 21 HA PRO 21 -6.957 5.832 10.114
138 1HB PRO 21 1HB PRO 21 -7.978 8.260 9.386
139 2HB PRO 21 2HB PRO 21 -7.676 7.808 11.052
140 1HG PRO 21 1HG PRO 21 -6.128 9.633 9.318
141 2HG PRO 21 2HG PRO 21 -6.105 9.497 11.066
142 1HD PRO 21 1HD PRO 21 -4.134 8.493 9.238
143 2HD PRO 21 2HD PRO 21 -4.171 8.255 10.974
144 H THR 22 H THR 22 -8.433 5.087 8.616
145 HA THR 22 HA THR 22 -7.554 5.626 5.855
146 HB THR 22 HB THR 22 -8.704 3.098 7.148
147 HG1 THR 22 HG1 THR 22 -6.212 3.712 5.734
148 1HG2 THR 22 1HG2 THR 22 -7.862 3.718 4.268
149 2HG2 THR 22 2HG2 THR 22 -8.118 2.074 4.901
150 3HG2 THR 22 3HG2 THR 22 -9.482 3.214 4.809
151 H PHE 23 H PHE 23 -9.718 6.706 7.975
152 HA PHE 23 HA PHE 23 -12.031 6.363 6.233
153 1HB PHE 23 1HB PHE 23 -13.131 7.528 8.253
154 2HB PHE 23 2HB PHE 23 -12.384 5.989 8.635
155 HD1 PHE 23 HD1 PHE 23 -11.483 9.614 8.521
156 HD2 PHE 23 HD2 PHE 23 -11.037 5.887 10.502
157 HE1 PHE 23 HE1 PHE 23 -10.105 10.725 10.301
158 HE2 PHE 23 HE2 PHE 23 -9.661 6.998 12.283
159 HZ PHE 23 HZ PHE 23 -9.212 9.404 12.161
Start of MODEL 27
1 H GLU 1 H GLU 1 -10.228 -13.883 12.618
2 HA GLU 1 HA GLU 1 -8.939 -13.092 10.770
3 1HB GLU 1 1HB GLU 1 -9.628 -11.374 13.100
4 2HB GLU 1 2HB GLU 1 -8.517 -10.641 11.960
5 1HG GLU 1 1HG GLU 1 -10.123 -11.266 10.088
6 2HG GLU 1 2HG GLU 1 -11.254 -11.827 11.304
7 H ASN 2 H ASN 2 -6.985 -11.443 10.337
8 HA ASN 2 HA ASN 2 -4.740 -12.460 11.898
9 1HB ASN 2 1HB ASN 2 -4.933 -11.817 8.911
10 2HB ASN 2 2HB ASN 2 -3.401 -12.077 9.723
11 1HD2 ASN 2 2HD2 ASN 2 -4.545 -13.596 7.585
12 2HD2 ASN 2 1HD2 ASN 2 -4.752 -15.229 8.122
13 H PHE 3 H PHE 3 -3.152 -10.864 12.500
14 HA PHE 3 HA PHE 3 -4.025 -8.252 12.768
15 1HB PHE 3 1HB PHE 3 -1.549 -9.908 13.086
16 2HB PHE 3 2HB PHE 3 -1.210 -8.206 12.839
17 HD1 PHE 3 HD1 PHE 3 -2.727 -6.592 14.348
18 HD2 PHE 3 HD2 PHE 3 -1.807 -10.635 15.257
19 HE1 PHE 3 HE1 PHE 3 -3.179 -6.150 16.777
20 HE2 PHE 3 HE2 PHE 3 -2.259 -10.192 17.685
21 HZ PHE 3 HZ PHE 3 -2.939 -7.955 18.417
22 H ASN 4 H ASN 4 -2.341 -6.364 12.018
23 HA ASN 4 HA ASN 4 -1.602 -6.762 9.271
24 1HB ASN 4 1HB ASN 4 -3.959 -5.999 9.089
25 2HB ASN 4 2HB ASN 4 -3.635 -4.647 10.156
26 1HD2 ASN 4 2HD2 ASN 4 -3.382 -2.795 9.193
27 2HD2 ASN 4 1HD2 ASN 4 -2.726 -2.504 7.617
28 H GLY 5 H GLY 5 0.064 -6.437 11.507
29 1HA GLY 5 1HA GLY 5 2.027 -5.102 11.556
30 2HA GLY 5 2HA GLY 5 1.079 -3.696 11.118
31 H GLY 6 H GLY 6 -1.177 -4.170 12.923
32 1HA GLY 6 1HA GLY 6 -1.261 -4.634 15.376
33 2HA GLY 6 2HA GLY 6 0.176 -3.638 15.501
34 H CYS 7 H CYS 7 -2.964 -3.349 13.677
35 HA CYS 7 HA CYS 7 -3.095 -0.597 14.637
36 1HB CYS 7 1HB CYS 7 -4.457 -1.982 12.322
37 2HB CYS 7 2HB CYS 7 -4.842 -0.353 12.843
38 H LEU 8 H LEU 8 -5.684 0.037 14.750
39 HA LEU 8 HA LEU 8 -6.690 -1.702 16.828
40 1HB LEU 8 1HB LEU 8 -6.663 0.629 17.292
41 2HB LEU 8 2HB LEU 8 -7.480 1.016 15.791
42 HG LEU 8 HG LEU 8 -9.520 -0.137 16.629
43 1HD1 LEU 8 1HD1 LEU 8 -7.930 -1.430 18.372
44 2HD1 LEU 8 2HD1 LEU 8 -8.533 -0.128 19.426
45 3HD1 LEU 8 3HD1 LEU 8 -9.681 -1.215 18.608
46 1HD2 LEU 8 1HD2 LEU 8 -8.334 2.242 18.014
47 2HD2 LEU 8 2HD2 LEU 8 -9.697 2.143 16.873
48 3HD2 LEU 8 3HD2 LEU 8 -9.903 1.600 18.556
49 H ALA 9 H ALA 9 -7.902 -0.279 13.710
50 HA ALA 9 HA ALA 9 -8.830 -2.482 12.531
51 1HB ALA 9 1HB ALA 9 -10.595 -1.725 14.833
52 2HB ALA 9 2HB ALA 9 -11.379 -2.251 13.324
53 3HB ALA 9 3HB ALA 9 -10.231 -3.329 14.154
54 H GLY 10 H GLY 10 -8.665 -1.397 10.612
55 1HA GLY 10 1HA GLY 10 -10.065 -0.225 9.027
56 2HA GLY 10 2HA GLY 10 -10.443 0.944 10.276
57 H TYR 11 H TYR 11 -7.691 1.068 11.395
58 HA TYR 11 HA TYR 11 -6.691 3.119 9.768
59 1HB TYR 11 1HB TYR 11 -5.509 1.306 11.962
60 2HB TYR 11 2HB TYR 11 -4.699 2.752 11.395
61 HD1 TYR 11 HD1 TYR 11 -6.067 4.990 11.573
62 HD2 TYR 11 HD2 TYR 11 -6.977 1.437 13.776
63 HE1 TYR 11 HE1 TYR 11 -7.350 6.369 13.281
64 HE2 TYR 11 HE2 TYR 11 -8.257 2.828 15.476
65 HH TYR 11 HH TYR 11 -9.373 4.913 15.619
66 H MET 12 H MET 12 -4.545 3.222 8.712
67 HA MET 12 HA MET 12 -3.921 0.634 7.519
68 1HB MET 12 1HB MET 12 -2.971 2.156 5.632
69 2HB MET 12 2HB MET 12 -4.715 2.126 5.795
70 1HG MET 12 1HG MET 12 -4.768 4.261 6.893
71 2HG MET 12 2HG MET 12 -3.055 4.216 7.257
72 1HE MET 12 1HE MET 12 -2.344 6.418 6.300
73 2HE MET 12 2HE MET 12 -2.893 7.086 4.745
74 3HE MET 12 3HE MET 12 -4.062 6.810 6.058
75 H ARG 13 H ARG 13 -1.592 0.310 6.874
76 HA ARG 13 HA ARG 13 0.070 1.517 8.917
77 1HB ARG 13 1HB ARG 13 1.609 -0.401 8.498
78 2HB ARG 13 2HB ARG 13 -0.006 -0.960 8.885
79 1HG ARG 13 1HG ARG 13 0.024 -2.155 6.958
80 2HG ARG 13 2HG ARG 13 -0.057 -0.639 6.083
81 1HD ARG 13 1HD ARG 13 2.158 -0.721 5.473
82 2HD ARG 13 2HD ARG 13 2.675 -1.292 7.048
83 HE ARG 13 HE ARG 13 1.204 -3.267 5.415
84 1HH1 ARG 13 1HH1 ARG 13 4.338 -2.014 6.410
85 2HH1 ARG 13 2HH1 ARG 13 5.196 -3.453 5.970
86 1HH2 ARG 13 1HH2 ARG 13 2.334 -5.166 4.835
87 2HH2 ARG 13 2HH2 ARG 13 4.048 -5.258 5.068
88 H THR 14 H THR 14 1.091 3.354 8.145
89 HA THR 14 HA THR 14 1.559 3.850 5.427
90 HB THR 14 HB THR 14 3.119 5.648 6.537
91 HG1 THR 14 HG1 THR 14 2.524 5.662 8.922
92 1HG2 THR 14 1HG2 THR 14 0.555 5.897 6.021
93 2HG2 THR 14 2HG2 THR 14 0.327 5.558 7.754
94 3HG2 THR 14 3HG2 THR 14 1.263 6.983 7.242
95 H ALA 15 H ALA 15 4.194 4.740 5.211
96 HA ALA 15 HA ALA 15 5.471 2.205 4.744
97 1HB ALA 15 1HB ALA 15 5.430 4.223 3.171
98 2HB ALA 15 2HB ALA 15 6.583 4.994 4.287
99 3HB ALA 15 3HB ALA 15 7.024 3.484 3.456
100 H ASP 16 H ASP 16 5.010 3.912 7.498
101 HA ASP 16 HA ASP 16 7.745 3.456 8.394
102 1HB ASP 16 1HB ASP 16 5.689 5.532 8.991
103 2HB ASP 16 2HB ASP 16 6.539 4.932 10.400
104 H GLY 17 H GLY 17 4.416 2.492 8.536
105 1HA GLY 17 1HA GLY 17 3.748 0.493 9.554
106 2HA GLY 17 2HA GLY 17 4.999 0.676 10.767
107 H ARG 18 H ARG 18 3.893 3.765 10.522
108 HA ARG 18 HA ARG 18 2.519 3.601 12.937
109 1HB ARG 18 1HB ARG 18 2.474 5.902 10.921
110 2HB ARG 18 2HB ARG 18 2.145 6.024 12.637
111 1HG ARG 18 1HG ARG 18 4.512 5.169 13.073
112 2HG ARG 18 2HG ARG 18 4.810 5.277 11.349
113 1HD ARG 18 1HD ARG 18 5.437 7.435 11.735
114 2HD ARG 18 2HD ARG 18 3.730 7.787 11.913
115 HE ARG 18 HE ARG 18 3.995 7.898 14.255
116 1HH1 ARG 18 1HH1 ARG 18 6.904 6.591 12.768
117 2HH1 ARG 18 2HH1 ARG 18 7.849 6.705 14.215
118 1HH2 ARG 18 1HH2 ARG 18 5.241 8.048 16.165
119 2HH2 ARG 18 2HH2 ARG 18 6.896 7.539 16.160
120 H CYS 19 H CYS 19 0.471 2.751 13.166
121 HA CYS 19 HA CYS 19 -1.256 2.360 11.024
122 1HB CYS 19 1HB CYS 19 -1.784 2.403 14.001
123 2HB CYS 19 2HB CYS 19 -2.960 1.900 12.804
124 H LYS 20 H LYS 20 -2.057 4.077 9.835
125 HA LYS 20 HA LYS 20 -2.975 6.414 11.355
126 1HB LYS 20 1HB LYS 20 -1.385 6.119 8.950
127 2HB LYS 20 2HB LYS 20 -2.827 7.056 8.616
128 1HG LYS 20 1HG LYS 20 -2.228 8.777 10.066
129 2HG LYS 20 2HG LYS 20 -1.369 7.709 11.159
130 1HD LYS 20 1HD LYS 20 0.555 8.446 10.204
131 2HD LYS 20 2HD LYS 20 0.116 7.513 8.787
132 1HE LYS 20 1HE LYS 20 -1.298 10.103 8.895
133 2HE LYS 20 2HE LYS 20 0.443 10.301 8.896
134 1HZ LYS 20 1HZ LYS 20 0.453 8.732 6.981
135 2HZ LYS 20 2HZ LYS 20 -1.174 8.865 6.917
136 3HZ LYS 20 3HZ LYS 20 -0.236 10.181 6.678
137 HA PRO 21 HA PRO 21 -7.008 5.727 9.969
138 1HB PRO 21 1HB PRO 21 -7.979 8.208 9.361
139 2HB PRO 21 2HB PRO 21 -7.827 7.614 11.003
140 1HG PRO 21 1HG PRO 21 -6.144 9.584 9.580
141 2HG PRO 21 2HG PRO 21 -6.279 9.297 11.303
142 1HD PRO 21 1HD PRO 21 -4.141 8.457 9.585
143 2HD PRO 21 2HD PRO 21 -4.334 8.070 11.284
144 H THR 22 H THR 22 -8.297 5.067 8.285
145 HA THR 22 HA THR 22 -7.397 6.060 5.670
146 HB THR 22 HB THR 22 -7.232 3.329 6.822
147 HG1 THR 22 HG1 THR 22 -5.854 3.371 4.732
148 1HG2 THR 22 1HG2 THR 22 -9.242 3.053 5.295
149 2HG2 THR 22 2HG2 THR 22 -8.271 3.734 3.967
150 3HG2 THR 22 3HG2 THR 22 -7.802 2.187 4.712
151 H PHE 23 H PHE 23 -9.821 6.064 7.847
152 HA PHE 23 HA PHE 23 -11.953 5.278 6.082
153 1HB PHE 23 1HB PHE 23 -13.290 6.191 8.088
154 2HB PHE 23 2HB PHE 23 -12.164 4.913 8.501
155 HD1 PHE 23 HD1 PHE 23 -12.221 8.642 8.243
156 HD2 PHE 23 HD2 PHE 23 -10.826 5.231 10.349
157 HE1 PHE 23 HE1 PHE 23 -11.155 10.135 9.956
158 HE2 PHE 23 HE2 PHE 23 -9.761 6.724 12.062
159 HZ PHE 23 HZ PHE 23 -9.938 9.159 11.844
Start of MODEL 28
1 H GLU 1 H GLU 1 -14.762 -8.145 17.119
2 HA GLU 1 HA GLU 1 -12.659 -7.458 16.219
3 1HB GLU 1 1HB GLU 1 -15.058 -6.111 15.966
4 2HB GLU 1 2HB GLU 1 -13.987 -4.808 16.439
5 1HG GLU 1 1HG GLU 1 -12.503 -5.211 14.574
6 2HG GLU 1 2HG GLU 1 -13.245 -6.759 14.221
7 H ASN 2 H ASN 2 -10.748 -7.381 17.384
8 HA ASN 2 HA ASN 2 -10.108 -4.873 18.538
9 1HB ASN 2 1HB ASN 2 -10.027 -7.349 20.338
10 2HB ASN 2 2HB ASN 2 -9.515 -5.736 20.790
11 1HD2 ASN 2 2HD2 ASN 2 -12.010 -7.944 20.788
12 2HD2 ASN 2 1HD2 ASN 2 -13.347 -6.914 21.176
13 H PHE 3 H PHE 3 -7.853 -4.575 18.271
14 HA PHE 3 HA PHE 3 -5.862 -5.009 17.383
15 1HB PHE 3 1HB PHE 3 -5.534 -5.733 19.719
16 2HB PHE 3 2HB PHE 3 -6.335 -7.262 19.413
17 HD1 PHE 3 HD1 PHE 3 -3.336 -5.309 18.375
18 HD2 PHE 3 HD2 PHE 3 -5.061 -9.144 18.942
19 HE1 PHE 3 HE1 PHE 3 -1.115 -6.378 17.900
20 HE2 PHE 3 HE2 PHE 3 -2.841 -10.213 18.466
21 HZ PHE 3 HZ PHE 3 -0.894 -8.817 17.951
22 H ASN 4 H ASN 4 -6.288 -5.486 15.186
23 HA ASN 4 HA ASN 4 -6.613 -8.318 14.616
24 1HB ASN 4 1HB ASN 4 -7.130 -7.329 12.229
25 2HB ASN 4 2HB ASN 4 -8.346 -7.159 13.480
26 1HD2 ASN 4 2HD2 ASN 4 -6.606 -5.598 11.144
27 2HD2 ASN 4 1HD2 ASN 4 -6.786 -3.949 11.644
28 H GLY 5 H GLY 5 -4.081 -7.988 15.338
29 1HA GLY 5 1HA GLY 5 -2.157 -8.742 14.112
30 2HA GLY 5 2HA GLY 5 -2.569 -7.627 12.825
31 H GLY 6 H GLY 6 -3.271 -5.315 14.416
32 1HA GLY 6 1HA GLY 6 -1.296 -4.667 16.322
33 2HA GLY 6 2HA GLY 6 -0.768 -4.122 14.742
34 H CYS 7 H CYS 7 -2.648 -2.983 13.391
35 HA CYS 7 HA CYS 7 -3.241 -0.636 14.627
36 1HB CYS 7 1HB CYS 7 -4.636 -2.015 12.330
37 2HB CYS 7 2HB CYS 7 -4.999 -0.375 12.829
38 H LEU 8 H LEU 8 -5.745 0.148 14.819
39 HA LEU 8 HA LEU 8 -6.825 -1.481 16.923
40 1HB LEU 8 1HB LEU 8 -6.753 0.872 17.253
41 2HB LEU 8 2HB LEU 8 -7.563 1.187 15.732
42 HG LEU 8 HG LEU 8 -9.626 0.133 16.630
43 1HD1 LEU 8 1HD1 LEU 8 -8.017 -1.058 18.473
44 2HD1 LEU 8 2HD1 LEU 8 -8.714 0.269 19.432
45 3HD1 LEU 8 3HD1 LEU 8 -9.783 -0.899 18.618
46 1HD2 LEU 8 1HD2 LEU 8 -8.441 2.482 18.122
47 2HD2 LEU 8 2HD2 LEU 8 -9.521 2.502 16.707
48 3HD2 LEU 8 3HD2 LEU 8 -10.137 1.967 18.290
49 H ALA 9 H ALA 9 -8.012 -0.217 13.728
50 HA ALA 9 HA ALA 9 -8.987 -2.466 12.680
51 1HB ALA 9 1HB ALA 9 -10.648 -1.626 14.996
52 2HB ALA 9 2HB ALA 9 -11.548 -2.012 13.509
53 3HB ALA 9 3HB ALA 9 -10.468 -3.226 14.236
54 H GLY 10 H GLY 10 -8.693 -1.417 10.736
55 1HA GLY 10 1HA GLY 10 -10.094 -0.336 9.063
56 2HA GLY 10 2HA GLY 10 -10.467 0.902 10.247
57 H TYR 11 H TYR 11 -7.812 1.185 11.414
58 HA TYR 11 HA TYR 11 -6.742 3.099 9.721
59 1HB TYR 11 1HB TYR 11 -5.615 1.324 11.972
60 2HB TYR 11 2HB TYR 11 -4.730 2.699 11.342
61 HD1 TYR 11 HD1 TYR 11 -7.677 1.652 13.298
62 HD2 TYR 11 HD2 TYR 11 -5.371 4.973 11.900
63 HE1 TYR 11 HE1 TYR 11 -8.876 3.183 14.936
64 HE2 TYR 11 HE2 TYR 11 -6.577 6.494 13.543
65 HH TYR 11 HH TYR 11 -8.995 5.167 15.783
66 H MET 12 H MET 12 -4.617 3.154 8.636
67 HA MET 12 HA MET 12 -4.021 0.528 7.511
68 1HB MET 12 1HB MET 12 -3.177 1.874 5.524
69 2HB MET 12 2HB MET 12 -4.887 2.105 5.827
70 1HG MET 12 1HG MET 12 -4.611 4.325 6.278
71 2HG MET 12 2HG MET 12 -3.275 4.018 7.370
72 1HE MET 12 1HE MET 12 -4.309 5.925 5.094
73 2HE MET 12 2HE MET 12 -2.727 6.720 4.906
74 3HE MET 12 3HE MET 12 -3.456 5.852 3.533
75 H ARG 13 H ARG 13 -1.654 0.365 6.662
76 HA ARG 13 HA ARG 13 0.018 1.500 8.747
77 1HB ARG 13 1HB ARG 13 0.439 -0.947 6.957
78 2HB ARG 13 2HB ARG 13 1.612 -0.380 8.130
79 1HG ARG 13 1HG ARG 13 -0.890 -0.551 9.514
80 2HG ARG 13 2HG ARG 13 -0.751 -2.018 8.565
81 1HD ARG 13 1HD ARG 13 1.836 -1.553 9.706
82 2HD ARG 13 2HD ARG 13 0.676 -1.283 10.991
83 HE ARG 13 HE ARG 13 0.018 -3.557 10.884
84 1HH1 ARG 13 1HH1 ARG 13 2.215 -2.772 8.250
85 2HH1 ARG 13 2HH1 ARG 13 2.485 -4.426 7.812
86 1HH2 ARG 13 1HH2 ARG 13 0.374 -5.739 10.307
87 2HH2 ARG 13 2HH2 ARG 13 1.431 -6.125 8.990
88 H THR 14 H THR 14 1.061 3.339 8.025
89 HA THR 14 HA THR 14 1.441 3.927 5.305
90 HB THR 14 HB THR 14 2.629 5.870 6.211
91 HG1 THR 14 HG1 THR 14 3.799 5.522 8.068
92 1HG2 THR 14 1HG2 THR 14 0.129 4.949 7.417
93 2HG2 THR 14 2HG2 THR 14 1.099 5.838 8.615
94 3HG2 THR 14 3HG2 THR 14 0.651 6.617 7.079
95 H ALA 15 H ALA 15 4.239 4.907 5.529
96 HA ALA 15 HA ALA 15 5.487 2.338 4.887
97 1HB ALA 15 1HB ALA 15 5.301 4.338 3.242
98 2HB ALA 15 2HB ALA 15 6.568 5.091 4.239
99 3HB ALA 15 3HB ALA 15 6.883 3.544 3.417
100 H ASP 16 H ASP 16 5.016 3.996 7.597
101 HA ASP 16 HA ASP 16 7.818 3.855 8.390
102 1HB ASP 16 1HB ASP 16 5.593 5.716 9.013
103 2HB ASP 16 2HB ASP 16 6.455 5.176 10.440
104 H GLY 17 H GLY 17 4.609 2.542 8.673
105 1HA GLY 17 1HA GLY 17 4.200 0.482 9.705
106 2HA GLY 17 2HA GLY 17 5.487 0.784 10.855
107 H ARG 18 H ARG 18 3.819 3.699 10.473
108 HA ARG 18 HA ARG 18 2.560 3.293 13.004
109 1HB ARG 18 1HB ARG 18 2.289 5.687 13.050
110 2HB ARG 18 2HB ARG 18 3.850 5.405 12.304
111 1HG ARG 18 1HG ARG 18 2.433 5.415 10.040
112 2HG ARG 18 2HG ARG 18 1.263 6.289 11.009
113 1HD ARG 18 1HD ARG 18 4.198 7.112 10.835
114 2HD ARG 18 2HD ARG 18 2.975 7.735 9.746
115 HE ARG 18 HE ARG 18 1.835 8.227 12.189
116 1HH1 ARG 18 1HH1 ARG 18 5.047 8.888 10.914
117 2HH1 ARG 18 2HH1 ARG 18 5.288 10.293 11.898
118 1HH2 ARG 18 1HH2 ARG 18 2.152 10.080 13.488
119 2HH2 ARG 18 2HH2 ARG 18 3.630 10.975 13.372
120 H CYS 19 H CYS 19 0.444 2.634 13.207
121 HA CYS 19 HA CYS 19 -1.178 2.219 10.991
122 1HB CYS 19 1HB CYS 19 -1.834 2.369 13.937
123 2HB CYS 19 2HB CYS 19 -2.993 1.900 12.708
124 H LYS 20 H LYS 20 -1.896 3.896 9.701
125 HA LYS 20 HA LYS 20 -2.677 6.375 11.045
126 1HB LYS 20 1HB LYS 20 -1.278 5.755 8.594
127 2HB LYS 20 2HB LYS 20 -2.710 6.699 8.236
128 1HG LYS 20 1HG LYS 20 -2.035 8.381 9.961
129 2HG LYS 20 2HG LYS 20 -0.606 7.436 10.327
130 1HD LYS 20 1HD LYS 20 0.521 8.235 8.513
131 2HD LYS 20 2HD LYS 20 -0.837 7.952 7.441
132 1HE LYS 20 1HE LYS 20 -1.057 10.241 9.392
133 2HE LYS 20 2HE LYS 20 0.023 10.442 8.026
134 1HZ LYS 20 1HZ LYS 20 -2.626 9.395 7.498
135 2HZ LYS 20 2HZ LYS 20 -2.497 10.984 7.850
136 3HZ LYS 20 3HZ LYS 20 -1.689 10.362 6.574
137 HA PRO 21 HA PRO 21 -6.837 5.792 10.043
138 1HB PRO 21 1HB PRO 21 -7.727 8.249 9.245
139 2HB PRO 21 2HB PRO 21 -7.473 7.822 10.925
140 1HG PRO 21 1HG PRO 21 -5.812 9.529 9.174
141 2HG PRO 21 2HG PRO 21 -5.820 9.432 10.924
142 1HD PRO 21 1HD PRO 21 -3.875 8.292 9.152
143 2HD PRO 21 2HD PRO 21 -3.949 8.096 10.891
144 H THR 22 H THR 22 -8.352 5.121 8.536
145 HA THR 22 HA THR 22 -7.395 5.534 5.779
146 HB THR 22 HB THR 22 -8.614 3.104 7.181
147 HG1 THR 22 HG1 THR 22 -6.253 3.514 5.499
148 1HG2 THR 22 1HG2 THR 22 -8.030 3.601 4.214
149 2HG2 THR 22 2HG2 THR 22 -8.298 1.990 4.923
150 3HG2 THR 22 3HG2 THR 22 -9.610 3.192 4.925
151 H PHE 23 H PHE 23 -9.531 6.775 7.845
152 HA PHE 23 HA PHE 23 -11.756 6.635 5.942
153 1HB PHE 23 1HB PHE 23 -13.039 7.483 7.973
154 2HB PHE 23 2HB PHE 23 -12.262 5.941 8.271
155 HD1 PHE 23 HD1 PHE 23 -12.241 9.510 9.056
156 HD2 PHE 23 HD2 PHE 23 -10.358 5.776 9.777
157 HE1 PHE 23 HE1 PHE 23 -11.080 10.481 11.058
158 HE2 PHE 23 HE2 PHE 23 -9.196 6.748 11.778
159 HZ PHE 23 HZ PHE 23 -9.571 9.088 12.395
Start of MODEL 29
1 H GLU 1 H GLU 1 0.050 -8.092 12.690
2 HA GLU 1 HA GLU 1 2.123 -8.187 11.508
3 1HB GLU 1 1HB GLU 1 0.007 -10.227 11.280
4 2HB GLU 1 2HB GLU 1 1.218 -10.381 10.023
5 1HG GLU 1 1HG GLU 1 2.965 -10.122 11.966
6 2HG GLU 1 2HG GLU 1 1.619 -10.466 13.034
7 H ASN 2 H ASN 2 1.402 -5.989 10.217
8 HA ASN 2 HA ASN 2 1.606 -4.928 8.335
9 1HB ASN 2 1HB ASN 2 2.929 -7.456 7.771
10 2HB ASN 2 2HB ASN 2 2.074 -6.948 6.328
11 1HD2 ASN 2 2HD2 ASN 2 4.741 -6.461 8.389
12 2HD2 ASN 2 1HD2 ASN 2 5.469 -5.103 7.598
13 H PHE 3 H PHE 3 -0.839 -6.771 9.174
14 HA PHE 3 HA PHE 3 -2.282 -6.391 6.655
15 1HB PHE 3 1HB PHE 3 -1.493 -8.846 7.666
16 2HB PHE 3 2HB PHE 3 -3.002 -8.646 8.535
17 HD1 PHE 3 HD1 PHE 3 -1.506 -8.913 5.174
18 HD2 PHE 3 HD2 PHE 3 -5.099 -8.902 7.433
19 HE1 PHE 3 HE1 PHE 3 -2.768 -9.747 3.171
20 HE2 PHE 3 HE2 PHE 3 -6.361 -9.736 5.430
21 HZ PHE 3 HZ PHE 3 -5.181 -10.149 3.323
22 H ASN 4 H ASN 4 -2.610 -7.157 10.196
23 HA ASN 4 HA ASN 4 -4.048 -4.926 10.790
24 1HB ASN 4 1HB ASN 4 -5.689 -6.501 9.231
25 2HB ASN 4 2HB ASN 4 -6.077 -7.138 10.816
26 1HD2 ASN 4 2HD2 ASN 4 -6.446 -5.453 12.542
27 2HD2 ASN 4 1HD2 ASN 4 -7.410 -4.075 12.127
28 H GLY 5 H GLY 5 -2.004 -6.600 11.901
29 1HA GLY 5 1HA GLY 5 -3.361 -7.838 14.222
30 2HA GLY 5 2HA GLY 5 -1.843 -8.388 13.542
31 H GLY 6 H GLY 6 -2.877 -4.965 14.036
32 1HA GLY 6 1HA GLY 6 -1.287 -4.652 16.416
33 2HA GLY 6 2HA GLY 6 -0.530 -3.979 14.986
34 H CYS 7 H CYS 7 -2.585 -2.929 13.484
35 HA CYS 7 HA CYS 7 -3.086 -0.531 14.717
36 1HB CYS 7 1HB CYS 7 -4.375 -1.919 12.379
37 2HB CYS 7 2HB CYS 7 -4.930 -0.348 12.919
38 H LEU 8 H LEU 8 -5.650 0.242 14.792
39 HA LEU 8 HA LEU 8 -6.715 -1.281 16.979
40 1HB LEU 8 1HB LEU 8 -6.725 1.085 17.161
41 2HB LEU 8 2HB LEU 8 -7.506 1.282 15.605
42 HG LEU 8 HG LEU 8 -9.580 0.330 16.479
43 1HD1 LEU 8 1HD1 LEU 8 -8.353 -1.171 18.152
44 2HD1 LEU 8 2HD1 LEU 8 -8.354 0.243 19.234
45 3HD1 LEU 8 3HD1 LEU 8 -9.894 -0.445 18.668
46 1HD2 LEU 8 1HD2 LEU 8 -8.468 2.816 17.143
47 2HD2 LEU 8 2HD2 LEU 8 -10.189 2.363 17.130
48 3HD2 LEU 8 3HD2 LEU 8 -9.244 2.230 18.634
49 H ALA 9 H ALA 9 -7.948 -0.229 13.723
50 HA ALA 9 HA ALA 9 -8.811 -2.558 12.764
51 1HB ALA 9 1HB ALA 9 -10.574 -1.667 15.014
52 2HB ALA 9 2HB ALA 9 -11.364 -2.331 13.564
53 3HB ALA 9 3HB ALA 9 -10.176 -3.310 14.457
54 H GLY 10 H GLY 10 -8.323 -1.272 10.918
55 1HA GLY 10 1HA GLY 10 -9.901 -0.410 9.171
56 2HA GLY 10 2HA GLY 10 -10.311 0.838 10.332
57 H TYR 11 H TYR 11 -7.617 1.174 11.464
58 HA TYR 11 HA TYR 11 -6.644 3.139 9.778
59 1HB TYR 11 1HB TYR 11 -5.403 1.339 11.947
60 2HB TYR 11 2HB TYR 11 -4.561 2.739 11.312
61 HD1 TYR 11 HD1 TYR 11 -7.412 1.610 13.360
62 HD2 TYR 11 HD2 TYR 11 -5.223 4.996 11.929
63 HE1 TYR 11 HE1 TYR 11 -8.571 3.091 15.070
64 HE2 TYR 11 HE2 TYR 11 -6.390 6.466 13.644
65 HH TYR 11 HH TYR 11 -9.051 5.883 15.002
66 H MET 12 H MET 12 -4.559 3.267 8.621
67 HA MET 12 HA MET 12 -3.992 0.698 7.364
68 1HB MET 12 1HB MET 12 -3.011 2.304 5.532
69 2HB MET 12 2HB MET 12 -4.755 2.229 5.684
70 1HG MET 12 1HG MET 12 -4.874 4.323 6.829
71 2HG MET 12 2HG MET 12 -3.177 4.287 7.266
72 1HE MET 12 1HE MET 12 -4.108 6.656 6.520
73 2HE MET 12 2HE MET 12 -2.456 6.889 5.901
74 3HE MET 12 3HE MET 12 -3.856 7.291 4.877
75 H ARG 13 H ARG 13 -1.678 0.375 6.617
76 HA ARG 13 HA ARG 13 0.047 1.362 8.716
77 1HB ARG 13 1HB ARG 13 0.400 -0.901 6.687
78 2HB ARG 13 2HB ARG 13 1.605 -0.472 7.885
79 1HG ARG 13 1HG ARG 13 -0.924 -0.747 9.247
80 2HG ARG 13 2HG ARG 13 -0.724 -2.146 8.210
81 1HD ARG 13 1HD ARG 13 1.751 -2.165 9.213
82 2HD ARG 13 2HD ARG 13 1.028 -1.219 10.499
83 HE ARG 13 HE ARG 13 -0.631 -3.506 9.963
84 1HH1 ARG 13 1HH1 ARG 13 2.460 -2.653 11.412
85 2HH1 ARG 13 2HH1 ARG 13 2.472 -4.006 12.493
86 1HH2 ARG 13 1HH2 ARG 13 -0.616 -5.292 11.388
87 2HH2 ARG 13 2HH2 ARG 13 0.710 -5.517 12.480
88 H THR 14 H THR 14 1.042 3.290 8.149
89 HA THR 14 HA THR 14 1.490 4.050 5.467
90 HB THR 14 HB THR 14 2.711 5.938 6.594
91 HG1 THR 14 HG1 THR 14 3.304 5.592 8.740
92 1HG2 THR 14 1HG2 THR 14 0.215 5.058 8.141
93 2HG2 THR 14 2HG2 THR 14 0.902 6.700 8.126
94 3HG2 THR 14 3HG2 THR 14 0.199 6.016 6.642
95 H ALA 15 H ALA 15 4.137 5.111 5.559
96 HA ALA 15 HA ALA 15 5.551 2.637 4.969
97 1HB ALA 15 1HB ALA 15 5.308 5.006 3.620
98 2HB ALA 15 2HB ALA 15 6.840 5.266 4.487
99 3HB ALA 15 3HB ALA 15 6.656 3.866 3.405
100 H ASP 16 H ASP 16 4.913 3.724 7.778
101 HA ASP 16 HA ASP 16 7.693 3.721 8.648
102 1HB ASP 16 1HB ASP 16 6.539 5.985 8.878
103 2HB ASP 16 2HB ASP 16 5.396 5.236 9.974
104 H GLY 17 H GLY 17 4.974 1.939 8.393
105 1HA GLY 17 1HA GLY 17 4.281 0.068 9.454
106 2HA GLY 17 2HA GLY 17 5.554 0.277 10.640
107 H ARG 18 H ARG 18 3.750 3.180 10.286
108 HA ARG 18 HA ARG 18 2.695 2.848 12.880
109 1HB ARG 18 1HB ARG 18 3.013 5.017 10.899
110 2HB ARG 18 2HB ARG 18 1.491 5.139 11.759
111 1HG ARG 18 1HG ARG 18 3.747 4.488 13.553
112 2HG ARG 18 2HG ARG 18 3.988 6.000 12.700
113 1HD ARG 18 1HD ARG 18 1.538 6.580 13.413
114 2HD ARG 18 2HD ARG 18 1.678 5.239 14.532
115 HE ARG 18 HE ARG 18 3.926 7.119 14.679
116 1HH1 ARG 18 1HH1 ARG 18 0.698 6.372 15.865
117 2HH1 ARG 18 2HH1 ARG 18 0.884 7.285 17.324
118 1HH2 ARG 18 1HH2 ARG 18 4.172 8.324 16.605
119 2HH2 ARG 18 2HH2 ARG 18 2.873 8.404 17.748
120 H CYS 19 H CYS 19 0.185 4.143 12.804
121 HA CYS 19 HA CYS 19 -1.397 2.469 11.006
122 1HB CYS 19 1HB CYS 19 -1.814 2.803 13.980
123 2HB CYS 19 2HB CYS 19 -3.046 2.193 12.892
124 H LYS 20 H LYS 20 -1.884 4.247 9.642
125 HA LYS 20 HA LYS 20 -2.899 6.658 10.915
126 1HB LYS 20 1HB LYS 20 -1.515 6.012 8.442
127 2HB LYS 20 2HB LYS 20 -2.960 6.950 8.123
128 1HG LYS 20 1HG LYS 20 -1.041 8.450 8.532
129 2HG LYS 20 2HG LYS 20 -2.250 8.658 9.784
130 1HD LYS 20 1HD LYS 20 -0.937 7.044 11.242
131 2HD LYS 20 2HD LYS 20 0.307 7.001 10.007
132 1HE LYS 20 1HE LYS 20 0.313 9.621 10.223
133 2HE LYS 20 2HE LYS 20 -0.551 9.358 11.725
134 1HZ LYS 20 1HZ LYS 20 1.557 7.601 11.725
135 2HZ LYS 20 2HZ LYS 20 2.175 9.021 11.204
136 3HZ LYS 20 3HZ LYS 20 1.393 8.946 12.637
137 HA PRO 21 HA PRO 21 -7.025 5.831 9.956
138 1HB PRO 21 1HB PRO 21 -8.048 8.232 9.149
139 2HB PRO 21 2HB PRO 21 -7.761 7.830 10.830
140 1HG PRO 21 1HG PRO 21 -6.203 9.612 9.060
141 2HG PRO 21 2HG PRO 21 -6.196 9.524 10.810
142 1HD PRO 21 1HD PRO 21 -4.204 8.476 9.032
143 2HD PRO 21 2HD PRO 21 -4.258 8.288 10.775
144 H THR 22 H THR 22 -8.432 4.975 8.470
145 HA THR 22 HA THR 22 -7.425 5.273 5.727
146 HB THR 22 HB THR 22 -9.296 3.154 6.899
147 HG1 THR 22 HG1 THR 22 -6.410 3.118 6.400
148 1HG2 THR 22 1HG2 THR 22 -7.431 3.245 4.470
149 2HG2 THR 22 2HG2 THR 22 -8.270 1.784 5.041
150 3HG2 THR 22 3HG2 THR 22 -9.208 3.165 4.423
151 H PHE 23 H PHE 23 -9.464 6.930 7.587
152 HA PHE 23 HA PHE 23 -11.964 6.872 6.708
153 1HB PHE 23 1HB PHE 23 -10.174 9.374 6.716
154 2HB PHE 23 2HB PHE 23 -11.898 9.352 7.029
155 HD1 PHE 23 HD1 PHE 23 -11.773 6.797 8.799
156 HD2 PHE 23 HD2 PHE 23 -9.584 10.432 8.782
157 HE1 PHE 23 HE1 PHE 23 -11.326 6.538 11.255
158 HE2 PHE 23 HE2 PHE 23 -9.135 10.173 11.238
159 HZ PHE 23 HZ PHE 23 -10.011 8.229 12.446
Start of MODEL 30
1 H GLU 1 H GLU 1 -3.826 -15.585 11.189
2 HA GLU 1 HA GLU 1 -5.554 -14.479 12.412
3 1HB GLU 1 1HB GLU 1 -2.944 -12.986 12.001
4 2HB GLU 1 2HB GLU 1 -4.131 -12.417 13.158
5 1HG GLU 1 1HG GLU 1 -3.605 -14.050 14.657
6 2HG GLU 1 2HG GLU 1 -3.690 -15.307 13.438
7 H ASN 2 H ASN 2 -6.430 -12.119 12.872
8 HA ASN 2 HA ASN 2 -7.269 -11.115 10.280
9 1HB ASN 2 1HB ASN 2 -8.622 -11.615 12.808
10 2HB ASN 2 2HB ASN 2 -8.761 -9.909 12.432
11 1HD2 ASN 2 2HD2 ASN 2 -9.469 -13.167 11.425
12 2HD2 ASN 2 1HD2 ASN 2 -10.654 -12.806 10.214
13 H PHE 3 H PHE 3 -4.747 -10.560 12.124
14 HA PHE 3 HA PHE 3 -5.140 -7.774 12.775
15 1HB PHE 3 1HB PHE 3 -3.252 -10.031 13.283
16 2HB PHE 3 2HB PHE 3 -2.418 -8.510 13.038
17 HD1 PHE 3 HD1 PHE 3 -5.249 -9.946 14.997
18 HD2 PHE 3 HD2 PHE 3 -2.102 -7.103 14.849
19 HE1 PHE 3 HE1 PHE 3 -5.714 -9.306 17.379
20 HE2 PHE 3 HE2 PHE 3 -2.567 -6.464 17.230
21 HZ PHE 3 HZ PHE 3 -4.367 -7.573 18.468
22 H ASN 4 H ASN 4 -4.540 -6.062 11.514
23 HA ASN 4 HA ASN 4 -3.318 -6.730 8.993
24 1HB ASN 4 1HB ASN 4 -5.320 -5.245 9.017
25 2HB ASN 4 2HB ASN 4 -4.497 -4.115 10.074
26 1HD2 ASN 4 2HD2 ASN 4 -3.831 -2.388 9.080
27 2HD2 ASN 4 1HD2 ASN 4 -3.189 -2.271 7.474
28 H GLY 5 H GLY 5 -1.534 -7.050 11.156
29 1HA GLY 5 1HA GLY 5 0.756 -6.432 11.130
30 2HA GLY 5 2HA GLY 5 0.304 -4.782 10.751
31 H GLY 6 H GLY 6 -1.908 -4.542 12.660
32 1HA GLY 6 1HA GLY 6 -1.864 -5.134 15.161
33 2HA GLY 6 2HA GLY 6 -0.305 -4.335 15.123
34 H CYS 7 H CYS 7 -3.590 -3.688 13.681
35 HA CYS 7 HA CYS 7 -3.283 -0.942 14.649
36 1HB CYS 7 1HB CYS 7 -4.728 -2.079 12.263
37 2HB CYS 7 2HB CYS 7 -5.111 -0.492 12.899
38 H LEU 8 H LEU 8 -5.799 -0.004 14.793
39 HA LEU 8 HA LEU 8 -6.945 -1.600 16.894
40 1HB LEU 8 1HB LEU 8 -6.746 0.740 17.260
41 2HB LEU 8 2HB LEU 8 -7.547 1.120 15.748
42 HG LEU 8 HG LEU 8 -9.657 0.156 16.646
43 1HD1 LEU 8 1HD1 LEU 8 -8.264 -1.264 18.368
44 2HD1 LEU 8 2HD1 LEU 8 -8.499 0.163 19.407
45 3HD1 LEU 8 3HD1 LEU 8 -9.910 -0.707 18.756
46 1HD2 LEU 8 1HD2 LEU 8 -8.281 2.514 17.852
47 2HD2 LEU 8 2HD2 LEU 8 -9.735 2.427 16.829
48 3HD2 LEU 8 3HD2 LEU 8 -9.832 1.993 18.553
49 H ALA 9 H ALA 9 -8.087 -0.213 13.734
50 HA ALA 9 HA ALA 9 -9.172 -2.380 12.633
51 1HB ALA 9 1HB ALA 9 -10.724 -1.610 15.025
52 2HB ALA 9 2HB ALA 9 -11.705 -1.782 13.550
53 3HB ALA 9 3HB ALA 9 -10.706 -3.141 14.117
54 H GLY 10 H GLY 10 -8.719 -1.172 10.781
55 1HA GLY 10 1HA GLY 10 -10.138 -0.013 9.135
56 2HA GLY 10 2HA GLY 10 -10.453 1.192 10.369
57 H TYR 11 H TYR 11 -7.696 1.153 11.497
58 HA TYR 11 HA TYR 11 -6.573 3.128 9.850
59 1HB TYR 11 1HB TYR 11 -5.504 1.283 12.076
60 2HB TYR 11 2HB TYR 11 -4.621 2.682 11.498
61 HD1 TYR 11 HD1 TYR 11 -5.809 4.991 11.690
62 HD2 TYR 11 HD2 TYR 11 -7.047 1.501 13.832
63 HE1 TYR 11 HE1 TYR 11 -7.033 6.450 13.374
64 HE2 TYR 11 HE2 TYR 11 -8.267 2.972 15.509
65 HH TYR 11 HH TYR 11 -9.231 5.832 15.027
66 H MET 12 H MET 12 -4.487 3.106 8.735
67 HA MET 12 HA MET 12 -3.916 0.440 7.688
68 1HB MET 12 1HB MET 12 -3.012 1.875 5.677
69 2HB MET 12 2HB MET 12 -4.749 1.735 5.856
70 1HG MET 12 1HG MET 12 -4.854 3.926 6.999
71 2HG MET 12 2HG MET 12 -3.106 4.055 6.982
72 1HE MET 12 1HE MET 12 -3.822 6.276 6.238
73 2HE MET 12 2HE MET 12 -2.508 6.202 5.041
74 3HE MET 12 3HE MET 12 -4.128 6.751 4.551
75 H ARG 13 H ARG 13 -1.590 0.167 6.882
76 HA ARG 13 HA ARG 13 0.122 1.418 8.851
77 1HB ARG 13 1HB ARG 13 0.434 -1.072 7.110
78 2HB ARG 13 2HB ARG 13 1.752 -0.438 8.075
79 1HG ARG 13 1HG ARG 13 -0.770 -0.703 9.605
80 2HG ARG 13 2HG ARG 13 -0.201 -2.230 8.961
81 1HD ARG 13 1HD ARG 13 1.955 -0.572 10.162
82 2HD ARG 13 2HD ARG 13 0.714 -1.045 11.306
83 HE ARG 13 HE ARG 13 1.630 -3.254 9.607
84 1HH1 ARG 13 1HH1 ARG 13 2.208 -1.467 12.583
85 2HH1 ARG 13 2HH1 ARG 13 3.064 -2.765 13.347
86 1HH2 ARG 13 1HH2 ARG 13 2.759 -4.967 10.614
87 2HH2 ARG 13 2HH2 ARG 13 3.379 -4.769 12.219
88 H THR 14 H THR 14 0.985 3.328 8.046
89 HA THR 14 HA THR 14 1.332 3.875 5.327
90 HB THR 14 HB THR 14 2.442 5.877 6.177
91 HG1 THR 14 HG1 THR 14 2.665 4.156 8.545
92 1HG2 THR 14 1HG2 THR 14 0.015 4.900 7.416
93 2HG2 THR 14 2HG2 THR 14 1.000 5.695 8.669
94 3HG2 THR 14 3HG2 THR 14 0.532 6.591 7.204
95 H ALA 15 H ALA 15 4.079 4.952 5.426
96 HA ALA 15 HA ALA 15 5.406 2.423 4.798
97 1HB ALA 15 1HB ALA 15 5.107 4.691 3.320
98 2HB ALA 15 2HB ALA 15 6.662 5.032 4.115
99 3HB ALA 15 3HB ALA 15 6.469 3.561 3.131
100 H ASP 16 H ASP 16 4.938 4.080 7.512
101 HA ASP 16 HA ASP 16 7.758 4.025 8.247
102 1HB ASP 16 1HB ASP 16 6.208 6.177 8.462
103 2HB ASP 16 2HB ASP 16 5.595 5.369 9.891
104 H GLY 17 H GLY 17 4.599 2.617 8.598
105 1HA GLY 17 1HA GLY 17 4.260 0.557 9.649
106 2HA GLY 17 2HA GLY 17 5.571 0.891 10.762
107 H ARG 18 H ARG 18 3.799 3.759 10.403
108 HA ARG 18 HA ARG 18 2.615 3.321 12.971
109 1HB ARG 18 1HB ARG 18 2.324 5.704 13.050
110 2HB ARG 18 2HB ARG 18 3.857 5.461 12.238
111 1HG ARG 18 1HG ARG 18 2.519 5.552 10.014
112 2HG ARG 18 2HG ARG 18 1.173 6.143 10.968
113 1HD ARG 18 1HD ARG 18 3.934 7.452 10.978
114 2HD ARG 18 2HD ARG 18 2.631 7.962 9.922
115 HE ARG 18 HE ARG 18 1.530 7.930 12.513
116 1HH1 ARG 18 1HH1 ARG 18 4.148 9.603 10.860
117 2HH1 ARG 18 2HH1 ARG 18 4.042 11.018 11.853
118 1HH2 ARG 18 1HH2 ARG 18 1.389 9.797 13.823
119 2HH2 ARG 18 2HH2 ARG 18 2.462 11.129 13.549
120 H CYS 19 H CYS 19 0.503 2.664 13.229
121 HA CYS 19 HA CYS 19 -1.152 2.233 11.027
122 1HB CYS 19 1HB CYS 19 -1.692 2.282 13.996
123 2HB CYS 19 2HB CYS 19 -2.931 1.900 12.817
124 H LYS 20 H LYS 20 -1.883 3.941 9.782
125 HA LYS 20 HA LYS 20 -2.748 6.348 11.210
126 1HB LYS 20 1HB LYS 20 -1.245 5.885 8.787
127 2HB LYS 20 2HB LYS 20 -2.689 6.805 8.420
128 1HG LYS 20 1HG LYS 20 -2.103 8.352 10.368
129 2HG LYS 20 2HG LYS 20 -0.584 7.493 10.521
130 1HD LYS 20 1HD LYS 20 0.295 8.839 8.925
131 2HD LYS 20 2HD LYS 20 -0.798 8.120 7.759
132 1HE LYS 20 1HE LYS 20 -1.440 10.351 7.568
133 2HE LYS 20 2HE LYS 20 -2.561 9.831 8.811
134 1HZ LYS 20 1HZ LYS 20 -0.311 10.525 10.159
135 2HZ LYS 20 2HZ LYS 20 -0.435 11.673 9.003
136 3HZ LYS 20 3HZ LYS 20 -1.674 11.416 10.036
137 HA PRO 21 HA PRO 21 -6.847 5.762 9.965
138 1HB PRO 21 1HB PRO 21 -7.713 8.179 9.030
139 2HB PRO 21 2HB PRO 21 -7.543 7.817 10.735
140 1HG PRO 21 1HG PRO 21 -5.806 9.475 9.011
141 2HG PRO 21 2HG PRO 21 -5.906 9.442 10.761
142 1HD PRO 21 1HD PRO 21 -3.861 8.256 9.135
143 2HD PRO 21 2HD PRO 21 -4.025 8.125 10.874
144 H THR 22 H THR 22 -8.248 4.983 8.413
145 HA THR 22 HA THR 22 -7.096 5.212 5.712
146 HB THR 22 HB THR 22 -8.937 3.036 6.815
147 HG1 THR 22 HG1 THR 22 -6.728 3.492 7.897
148 1HG2 THR 22 1HG2 THR 22 -8.511 3.270 4.268
149 2HG2 THR 22 2HG2 THR 22 -6.806 2.912 4.629
150 3HG2 THR 22 3HG2 THR 22 -8.065 1.707 4.991
151 H PHE 23 H PHE 23 -9.248 6.809 7.493
152 HA PHE 23 HA PHE 23 -11.716 6.659 6.550
153 1HB PHE 23 1HB PHE 23 -10.024 9.226 6.540
154 2HB PHE 23 2HB PHE 23 -11.749 9.136 6.842
155 HD1 PHE 23 HD1 PHE 23 -11.669 6.703 8.689
156 HD2 PHE 23 HD2 PHE 23 -9.357 10.259 8.561
157 HE1 PHE 23 HE1 PHE 23 -11.230 6.506 11.152
158 HE2 PHE 23 HE2 PHE 23 -8.917 10.062 11.024
159 HZ PHE 23 HZ PHE 23 -9.859 8.188 12.290